β-NITROSTYRENE supplier | CasNO.102-96-5

Name
TRANS-BETA-NITROSTYRENE
EINECS 203-066-0
CAS No. 102-96-5
Article Data192
CAS DataBase
Density 1.177g/cm³
Solubility
Melting Point 55-58 °C(lit.)
Formula C8H7 N O2
Boiling Point 250-260 °C(lit.)
Molecular Weight 149.149
Flash Point 117.5°C
Transport Information
Appearance yellow crystals
Safety Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NO_x.
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms Styrene, b-nitro- (8CI);(2-Nitroethenyl)benzene; (2-Nitrovinyl)benzene; 1-Nitro-2-phenylethene;1-Nitro-2-phenylethylene; 1-Phenyl-2-nitroethene; 2-Nitro-1-phenylethylene;2-Phenyl-1-nitroethene; NSC 9809; b-Nitrostyrene; w-Nitrostyrene
PSA 45.82000
LogP 2.45720

Synthetic route

: 75-52-5
nitromethane

: 100-52-7
benzaldehyde

: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
With 3-(diethylamino)propyltrimethoxysilane supported on silica-alumina at 100℃; for 6h;	99%
With mesoporous hybrid catalyst HYB-75P-25B at 373℃; for 14h; Henry reaction; Inert atmosphere;	98%
With basic groups-derivatized mesoporous silica-enveloped Fe3O4 nanoparticles Henry Nitro Aldol Condensation;	98%

: 75-52-5
nitromethane

: 1125-88-8
benzaldehyde dimethyl acetal

A: 102-96-5
(2-nitroethenyl)benzene

B: 100-52-7
benzaldehyde

Conditions

Conditions	Yield
With benzenesulfonic acid and amine group containing periodic mesoporous organosilica at 90℃; for 20h;	A 97.5% B 2.5%
With DMAN-SO3H-SiO2-5-5 In water at 89.84℃; for 24h; Catalytic behavior; Time; Henry Nitro Aldol Condensation;	A 92% B 8%
With grDMAN-SO3H-SiO2-5 In water at 89.84℃; for 15h; Catalytic behavior; Time; Henry Nitro Aldol Condensation;	A 15% B 85%

...Expand

: 75-52-5
nitromethane

: 1125-88-8
benzaldehyde dimethyl acetal

: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
With porous aromatic framework PAF-1-NHCH2CH2NH2-SO3H at 90℃; for 24h; Inert atmosphere;	97.2%
With acidic-basic groups-derivatized mesoporous silica-enveloped Fe3O4 nanoparticles In water at 90℃; for 5h;	96%
With water at 90℃; for 5h; Inert atmosphere;	95 %Chromat.

: 140-10-3
(E)-3-phenylacrylic acid

: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
With copper(II) nitrate In acetonitrile at 85℃; for 5h; Inert atmosphere;	97%
With diethyl ether; mixture of gaseous nitrogen oxides
With sodium nitrite

: potassium styryltrifluoroborate

: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
With sodium dihydrogen phosphate monohydrate; dichloro[1,1'-bis(di-t-butylphosphino)ferrocene]palladium(II); sodium nitrite In toluene at 120℃; for 0.5h; Temperature; Reagent/catalyst; Solvent; Microwave irradiation; Inert atmosphere;	92%

: 141377-54-0, 145920-96-3, 149495-00-1, 15990-45-1
2-nitro-1-phenylethan-1-ol

: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
With N-heterocyclic carbenes modified magnesium nanoparticles In tetrahydrofuran at 60℃; for 20h; Reagent/catalyst; Temperature; Molecular sieve;	85%

: 621-82-9
Cinnamic acid

: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
With tert.-butylnitrite; silica gel In acetonitrile at 100℃; under 2250.23 Torr; Time; Temperature; Pressure; Solvent; Microwave irradiation;	85%
With Vilsmeier reagent; potassium nitrate In acetonitrile at 20℃; Reagent/catalyst; Temperature; Sonication;	82%
With nitric acid In acetonitrile for 0.025h; Solvent; Microwave irradiation;	78%
With trichloroisocyanuric acid; N,N-dimethyl-formamide; sodium nitrite for 8h; Reflux;	72%
Multi-step reaction with 2 steps 1: lime/chalk/ 2: nitric acid View Scheme

: 292638-84-7
styrene

: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
With iodine; sodium nitrite In water; ethylene glycol; ethyl acetate for 48h; Ambient temperature;	81%
With silver nitrate; acetyl chloride In acetonitrile at 0 - 65℃; for 1h;	55%
With tert.-butylnitrite In dimethyl sulfoxide at 80℃; for 24h; Inert atmosphere;	26%

: 17356-08-0
thiourea

A: 102-96-5
(2-nitroethenyl)benzene

B: 1071-86-9, 19040-64-3, 50606-57-0
bis(formamidine)disulphide dihydrobromide

Conditions

Conditions	Yield
With (1,2-dibromo-2-nitroethyl)benzene In acetone	A n/a B 81%

: 292638-84-7
styrene

A: 102-96-5
(2-nitroethenyl)benzene

B: 21205-24-3
2-nitro-1-phenylethan-1-one oxime

Conditions

Conditions	Yield
With tert.-butylnitrite; water In dimethyl sulfoxide at 50℃; for 1.5h;	A 6% B 81%

: 75-52-5
nitromethane

: 100-52-7
benzaldehyde

A: 102-96-5
(2-nitroethenyl)benzene

B: 117538-84-8
(1,3-dinitropropan-2-yl)benzene

Conditions

Conditions	Yield
With hexan-1-amine; silica gel In toluene at 90℃; for 1.5h;	A 80% B 14%
With cinchona alkaloid and aminopropyl group-based hybrid organic-inorganic catalyst In toluene at 70℃; for 5h; Henry Nitro Aldol Condensation;	A 51% B 18%
With ethylenediamine In water; toluene at 70℃; for 10h; Reagent/catalyst; Henry Nitro Aldol Condensation;	A 40% B 40%
With silica-alumina-supported amine catalyst at 100℃; for 8h;	A 71 %Spectr. B 29 %Spectr.

...Expand

: 75-52-5
nitromethane

: 100-52-7
benzaldehyde

A: 102-96-5
(2-nitroethenyl)benzene

B: 141377-54-0, 145920-96-3, 149495-00-1, 15990-45-1
2-nitro-1-phenylethan-1-ol

Conditions

Conditions	Yield
With ammonium acetate at 90℃; for 0.416667h; Henry reaction; Microwave irradiation;	A 71% B 12%
With ammonium acetate at 60℃; for 0.75h; Henry reaction; Ultrasound irradiation;	A 21% B 57%
With amino-functionalized MIL-101 catalyst In butan-1-ol at 80℃; for 8h;

...Expand

: 1345735-45-6
2-(2-nitro-1-phenylethoxy)-5-phenyltetrahydro-1,2-oxazole-3,3-dicarbonitrile

A: 102-96-5
(2-nitroethenyl)benzene

B: 61207-10-1
5-phenyl-4,5-dihydro-1,2-oxazole-3-carbonitrile 2-oxide

Conditions

Conditions	Yield
With water; acetic acid for 1h; Reflux;	A 52% B 70%

: 75-52-5
nitromethane

: 100-46-9
benzylamine

: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
With 4-(4-fluorophenyl)naphthalene-1,2-dione; oxygen at 80℃; for 12h;	67%

: 3425-99-8
(1,2-dibromo-2-nitroethyl)benzene

A: 102-96-5
(2-nitroethenyl)benzene

B: 1071-86-9, 19040-64-3, 50606-57-0
bis(formamidine)disulphide dihydrobromide

Conditions

Conditions	Yield
With thiourea In ethanol at 20 - 25℃; for 24h;	A n/a B 62.5%

: 292638-84-7
styrene

A: 102-96-5
(2-nitroethenyl)benzene

B: 2-nitro-1-phenylethyl nitrate

C: (1-Nitro-2-nitrooxy-ethyl)-benzene

Conditions

Conditions	Yield
With Nitrogen dioxide; ozone In dichloromethane at -20℃; Product distribution; multistep reaction;	A 58% B n/a C n/a

...Expand

: 75-52-5
nitromethane

: 100-52-7
benzaldehyde

A: 102-96-5
(2-nitroethenyl)benzene

B: 145920-96-3
(R)-2-nitro-1-phenylethanol

Conditions

Conditions	Yield
With copper(II) acetate monohydrate; (3aR,3a'R,8aS,8a'S)-2,2'-(propane-2,2-diyl)bis(8,8a-dihydro-3aH-indeno[1,2-d]oxazole) In ethanol at 20℃; for 24h; Henry reaction; Inert atmosphere; optical yield given as %ee; enantioselective reaction;	A 10% B 58%

...Expand

: 292638-84-7
styrene

A: 102-96-5
(2-nitroethenyl)benzene

B: 65-85-0
benzoic acid

Conditions

Conditions	Yield
With tert.-butylnitrite; oxygen In water; dimethyl sulfoxide at 50℃; for 1.5h;	A 38% B 32%

: 292638-84-7
styrene

: 10102-44-0
Nitrogen dioxide

A: 102-96-5
(2-nitroethenyl)benzene

B: 141377-54-0, 145920-96-3, 149495-00-1, 15990-45-1
2-nitro-1-phenylethan-1-ol

C: 100-52-7
benzaldehyde

D: 65-85-0
benzoic acid

E: 614-21-1
2-nitroacetophenone

Conditions

Conditions	Yield
In tetrachloromethane react. at 25°C under N2 (anaerobic), further products; products identified by g.c./m.s.;	A 1% B 33% C 7% D 5% E 31%
In tetrachloromethane react. at 25°C, further products; products identified by g.c./m.s.;	A 12% B 24% C 9% D 1% E 29%

...Expand

: 75-52-5
nitromethane

: 100-52-7
benzaldehyde

A: 102-96-5
(2-nitroethenyl)benzene

B: 141377-54-0, 145920-96-3, 149495-00-1, 15990-45-1
2-nitro-1-phenylethan-1-ol

C: 117538-84-8
(1,3-dinitropropan-2-yl)benzene

Conditions

Conditions	Yield
With N,N-dimethylethylenediamine In toluene at 50℃; for 1h; Henry Nitro Aldol Condensation;	A 32% B 18% C 18%
With 1,8-bis(tetramethylguanidino)naphthalene In neat (no solvent) at 129.84℃; Reagent/catalyst; Time; Henry Nitro Aldol Condensation; Inert atmosphere;	A 7% B 13% C 16%
With silica-alumina-supported double-amine catalyst at 100℃; for 8h;	A 3 %Spectr. B 4 %Spectr. C 93 %Spectr.
With silica-alumina-supported amine catalyst at 100℃; for 8h;	A 68 %Spectr. B 7 %Spectr. C 8 %Spectr.
With silica-alumina(500)-NEt2 at 100℃; for 20h;

...Expand

: 1707-07-9
dimethyl 2-phenylethenylphosphonate

A: 102-96-5
(2-nitroethenyl)benzene

B: 78728-63-9
dimethyl 2-hydroxy-1-nitro-2-phenylethylphosphonate

C: 88-75-5
2-hydroxynitrobenzene

Conditions

Conditions	Yield
With dinitrogen tetraoxide at 0 - 20℃; for 3h; Nitration;	A n/a B 30% C n/a

...Expand

: 4,5-dinitro-1,5-diphenyl-pent-1-en-3-one

A: 140-10-3
(E)-3-phenylacrylic acid

B: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
With potassium hydroxide

: 75-52-5
nitromethane

: 96-15-1
2-Methylbutylamine

: 100-52-7
benzaldehyde

: 102-96-5
(2-nitroethenyl)benzene

...Expand

: 75-52-5
nitromethane

: 141-52-6
sodium ethanolate

: 100-52-7
benzaldehyde

: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
Zerlegen des Produktes mit verd.Schwefelsaeure;

...Expand

: 75-52-5
nitromethane

: 100-52-7
benzaldehyde

: 5435-44-9, 22243-66-9
(E)-3-Ureido-but-2-enoic acid ethyl ester

: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
at 160℃; im geschlossenen Rohr;

...Expand

: 21080-09-1
NSC 4573

: 100-52-7
benzaldehyde

A: 102-96-5
(2-nitroethenyl)benzene

B: 538-51-2
benzylidene phenylamine

...Expand

: 75-52-5
nitromethane

: 64-17-5
ethanol

: 134-81-6
benzil

A: 102-96-5
(2-nitroethenyl)benzene

B: 141377-54-0, 145920-96-3, 149495-00-1, 15990-45-1
2-nitro-1-phenylethan-1-ol

Conditions

Conditions	Yield
Natriumverbindung reagiert, Einw. von Mineralsaeuren;

...Expand

: 75-52-5
nitromethane

: 134-81-6
benzil

: 102-96-5
(2-nitroethenyl)benzene

Conditions

Conditions	Yield
With pyridine; sodium ethanolate Behandlung des Reaktionsgemisches mit wss. HCl;

: 42604-93-3
1-Phenyl-2-nitroethyl-p-chlorphenylsulfon

A: 102-96-5
(2-nitroethenyl)benzene

B: 100-03-8
4-chlorobenzenesulfinic acid

Conditions

Conditions	Yield
With sodium hydroxide In acetone at 20℃; Rate constant; Equilibrium constant;

: 102-96-5
(2-nitroethenyl)benzene

: 6125-24-2
2-Phenylnitroethane

Conditions

Conditions	Yield
With polymer-bound NADH (2a)	100%
With magnesium(II) perchlorate; "grafted NADH model" reagent In acetonitrile; benzene at 80℃; for 120h;	100%
With tri(1-naphthyl)phosphonium tris(pentafluorophenyl)borohydride In dichloromethane-d2 for 12h; Reagent/catalyst; Glovebox; Sealed tube;	100%

: 102-96-5
(2-nitroethenyl)benzene

: 141-97-9
ethyl acetoacetate

: 72709-62-7
ethyl 2-acetyl-4-nitro-3-phenylbutyrate

Conditions

Conditions	Yield
With nickel polymer catalyst In chloroform for 48h; Reflux;	100%
With C23H37N3O9S In dichloromethane at 20℃; for 16h; asymmetric Michael addition; enantioselective reaction;	99%
With C31H36N6OS3 In toluene at 25℃; for 48h; Michael Addition; enantioselective reaction;	99%

: 102-96-5
(2-nitroethenyl)benzene

: 123-54-6
acetylacetone

: 72709-61-6
(+/-)-3-(2-nitro-1-phenylethyl)pentane-2,4-dione

Conditions

Conditions	Yield
With N,N-dimethyl-3-trimethoxysilylpropanamine:N-(3,5-bistrifluoromethylphenyl)-N'-(3-trimethoxysilyl-1-propyl)thiourea (1:1) mesoporous silica nanoparticles at 20℃; for 3h;	100%
With squaramide-containing Dawson organo-polyoxotungstates In dichloromethane for 13h; Reagent/catalyst; Heating;	99%
With C27H18F15N7O3 In dimethyl sulfoxide at 20℃; for 3h; Michael Addition;	98%

: 102-96-5
(2-nitroethenyl)benzene

: 100-53-8
phenylmethanethiol

: 34980-76-2, 63509-10-4, 63509-11-5
benzyl (2-nitro-1-phenylethyl) sulfide

Conditions

Conditions	Yield
at 20℃; for 0.1h; Michael addition; neat (no solvent);	100%
at 20℃; for 2h; Michael addition; Neat (no solvent); regioselective reaction;	92%
In water at 20℃; for 1h; thia-Michael addition;	91%
With 2,2'-azobis(isobutyronitrile); quinoclamine; N,N-dimethyl-formamide; Quinine In toluene

: 110-91-8
morpholine

: 102-96-5
(2-nitroethenyl)benzene

: 4-(2-nitro-1-phenylethyl)morpholine

Conditions

Conditions	Yield
at 20℃; for 0.0166667h; Michael addition; neat (no solvent);	100%
With MCM-41 immobilized phenanthrolinium dibromide In water at 20℃; for 0.5h; Catalytic behavior; Michael Addition;	95%
With samarium(III) trifluoromethanesulfonate In dichloromethane at 20℃; for 24h; Reagent/catalyst; Inert atmosphere;	94%

: 102-96-5
(2-nitroethenyl)benzene

: 85669-65-4
methyl-4-phenylmethylamino-2-butene-1-carboxylate

: (2RS,3SR,4SR)-1N-phenylmethyl-2-phenyl-3-nitro-4-carbomethoxymethylpyrrolidine

Conditions

Conditions	Yield
In methanol for 16h; Ambient temperature;	100%

: 102-96-5
(2-nitroethenyl)benzene

: 104-94-9
4-methoxy-aniline

: 4-methoxy-N-(2-nitro-1-phenylethyl)benzenamine

Conditions

Conditions	Yield
at 20℃; for 0.0166667h; Michael addition; Grinding; neat (no solvent);	100%
With magnesia at 25℃; for 0.3h; Green chemistry;	98%
With MCM-41 immobilized phenanthrolinium dibromide In water at 20℃; for 1.5h; Catalytic behavior; Michael Addition;	93%

: 102-96-5
(2-nitroethenyl)benzene

: 108-94-1
cyclohexanone

: 4591-64-4, 51262-17-0, 51262-18-1, 84025-84-3, 84025-87-6, 84025-83-2
(S)-2-[(R)-2-nitro-1-phenylethyl]cyclohexanone

Conditions

Conditions	Yield
With 2,6-bis(1-((S)-pyrrolidin-2-ylmethyl)-1H-1,2,3-triazol-4-yl)pyridine at 20℃; for 16h; Michael addition; optical yield given as %de;	100%
With C2HF3O2*C25H23N2O2PS; triethylamine; benzoic acid at -30℃; for 22h; Michael addition; stereoselective reaction;	99%
Stage #1: cyclohexanone With 3-butyl-1-(butyl-4-sulfobutyl)imidazolium trifluoromethanesulfonate; C13H28N2 In water at 20℃; for 0.333333h; Michael Addition; Green chemistry; Stage #2: (2-nitroethenyl)benzene In water at 20℃; for 10h; Green chemistry; enantioselective reaction;	99%

: 102-96-5
(2-nitroethenyl)benzene

: 106-45-6
para-thiocresol

: 92851-02-0
(2-nitro-1-phenylethyl)(p-tolyl)sulfane

Conditions

Conditions	Yield
at 20℃; for 0.1h; Michael addition; Grinding; neat (no solvent);	100%
In water at 20℃; for 0.166667h; thia-Michael addition;	94%
With squaric acid In water at 20℃; for 1.33333h; Michael addition;	85%

: 109-97-7
pyrrole

: 102-96-5
(2-nitroethenyl)benzene

: 112616-92-9
2-(2-nitro-1-phenylethan-1-yl)pyrrole

Conditions

Conditions	Yield
With [tetrapropylammonium]2[Zn2(1,4-benzenedicarboxylate)3(dimethylamine)2] In neat (no solvent) at 70℃; for 4h; Temperature; Reagent/catalyst; Michael Addition; Green chemistry;	100%
In water at 150℃; for 0.1h; Michael addition; Microwave irradiation;	99%
With UiO-66(Ce) metal-organic framework In 1,2-dichloro-ethane at 80℃; for 24h; Catalytic behavior; Friedel-Crafts Alkylation; Schlenk technique;	97%

: 102-96-5
(2-nitroethenyl)benzene

: 1679-18-1
4-Chlorophenylboronic acid

: 1245819-33-3
(R)-1-chloro-4-(2-nitro-1-phenylethyl)benzene

Conditions

Conditions	Yield
With heterogeneous Rh/Ag bimetallic nanoparticle catalyst immobilized on chiral polymer In water; toluene at 100℃; for 24h; Inert atmosphere; enantioselective reaction;	100%
With potassium hydrogen difluoride; C60H52Cl2Rh2 In water; toluene at 50℃; for 51h; Inert atmosphere; enantioselective reaction;	94%
With chlorobis(ethylene)rhodium(I) dimer; potassium hydrogen bifluoride; C28H22 In water; toluene at 100℃; Inert atmosphere; optical yield given as %ee; enantioselective reaction;	92%
With chlorobis(ethylene)rhodium(I) dimer; C17H27NO In water; toluene at 100℃; for 16h; Reagent/catalyst; Inert atmosphere; enantioselective reaction;	87 %Chromat.

: 102-96-5
(2-nitroethenyl)benzene

: 108-69-0
3,5-dimethylaminoaniline

: 1266995-18-9
C16H18N2O2

Conditions

Conditions	Yield
at 20℃; for 0.1h; Michael addition; neat (no solvent);	100%

: 848821-58-9
(2S)-2-{diphenyl[(trimethylsilyl)oxy]methyl}pyrrolidine

: 102-96-5
(2-nitroethenyl)benzene

: 590-86-3
isovaleraldehyde

: C31H38N2O3Si

Conditions

Conditions	Yield
With acetic acid In toluene at 25℃;	100%

...Expand

: 102-96-5
(2-nitroethenyl)benzene

: 1393357-24-8
5-ethyl-2-(m-tolyl)oxazol-4(5H)-one

: 1393357-08-8
(5R)-5-ethyl-5-((R)-2-nitro-1-phenylethyl)-2-(m-tolyl)oxazol-4(5H)-one

Conditions

Conditions	Yield
With 2,6-bis((2S-((2-naphthyl)2(HO)C)pyrrolidino)CH2)-4-Me-phenol; diethylzinc In tetrahydrofuran; hexane; propiononitrile at 20℃; for 16h; Michael reaction; Inert atmosphere; optical yield given as %ee; stereoselective reaction;	100%

: 102-96-5
(2-nitroethenyl)benzene

: 1393357-25-9
5-isobutyl-2-(m-tolyl)oxazol-4(5H)-one

: (5R)-5-isobutyl-5-((R)-2-nitro-1-phenylethyl)-2-(m-tolyl)oxazol-4(5H)-one

Conditions

Conditions	Yield
With 2,6-bis((2S-((2-naphthyl)2(HO)C)pyrrolidino)CH2)-4-Me-phenol; diethylzinc In tetrahydrofuran; hexane; propiononitrile at 20℃; for 16h; Michael reaction; Inert atmosphere; optical yield given as %ee; stereoselective reaction;	100%

: 102-96-5
(2-nitroethenyl)benzene

: 1393357-27-1
5-allyl-2-(m-tolyl)oxazol-4(5H)-one

: 1393357-11-3
(5R)-5-allyl-5-((R)-2-nitro-1-phenylethyl)-2-(m-tolyl)oxazol-4(5H)-one

Conditions

Conditions	Yield
With 2,6-bis((2S-((2-naphthyl)2(HO)C)pyrrolidino)CH2)-4-Me-phenol; diethylzinc In tetrahydrofuran; hexane; propiononitrile at 20℃; for 16h; Michael reaction; Inert atmosphere; optical yield given as %ee; stereoselective reaction;	100%

: 102-96-5
(2-nitroethenyl)benzene

: 1393357-29-3
5-(2-(methylthio)ethyl)-2-(m-tolyl)oxazol-4(5H)-one

: 1393357-13-5
(5R)-5-(2-(methylthio)ethyl)-5-((R)-2-nitro-1-phenylethyl)-2-(m-tolyl)oxazol-4(5H)-one

Conditions

Conditions	Yield
With 2,6-bis((2S-((2-naphthyl)2(HO)C)pyrrolidino)CH2)-4-Me-phenol; diethylzinc In tetrahydrofuran; hexane; propiononitrile at 20℃; for 16h; Michael reaction; Inert atmosphere; optical yield given as %ee; stereoselective reaction;	100%

: 102-96-5
(2-nitroethenyl)benzene

: 6-[1-aza-2-(dimethylamino)prop-1-enyl]-1,3-dimethyl uracil

: C18H21N5O4

Conditions

Conditions	Yield
In water at 20℃; for 8h; Solvent; regioselective reaction;	100%

: 39718-00-8
2-chlorobenzylthiol

: 102-96-5
(2-nitroethenyl)benzene

: (S)-2-chlorobenzyl (2-nitro-1-phenylethyl) sulfide

Conditions

Conditions	Yield
Stage #1: (2-nitroethenyl)benzene With 1-[(3R,4S)-1-benzyl-4-phenylpyrrolidin-3-yl]-3-[3,5-bis(trifluoromethyl)phenyl]urea In dichloromethane at 20℃; for 0.333333h; Molecular sieve; Stage #2: 2-chlorobenzylthiol In dichloromethane at -80℃; for 48h; Michael Addition; Molecular sieve; enantioselective reaction;	100%

: 120-72-9
indole

: 102-96-5
(2-nitroethenyl)benzene

: 51626-47-2
3-(2-nitro-1-phenylethyl)-1H-indole

Conditions

Conditions	Yield
With 2,2,2-trifluoroethanol; 1-(3,5-bis(trifluoromethyl)phenyl)-3-(2-(difluoroboryl)phenyl)urea In dichloromethane at 23℃; for 24h; Kinetics; Reagent/catalyst; Inert atmosphere;	99%
Stage #1: (2-nitroethenyl)benzene With C24H12F8N2O7Si2 In 1,2-dichloro-benzene for 0.0833333h; Inert atmosphere; Stage #2: indole In 1,2-dichloro-benzene at 23℃; for 24h; Reagent/catalyst; Solvent; Inert atmosphere;	99%
With zinc diacetate In ethanol at 20℃; for 0.333333h; Michael addition;	98%

: 102-96-5
(2-nitroethenyl)benzene

: 62-53-3
aniline

: 21080-09-1
NSC 4573

Conditions

Conditions	Yield
at 20℃; for 0.116667h; Michael addition; neat (no solvent);	99%
With magnesia at 25℃; for 0.4h; Green chemistry;	95%
With iranian dolomite In water at 20℃; for 0.5h; Michael Addition;	93%

: 102-96-5
(2-nitroethenyl)benzene

: 91-60-1
2-Naphthalenethiol

: 110130-43-3
[2]naphthyl-(2-nitro-1-phenyl-ethyl)-sulfide

Conditions

Conditions	Yield
at 20℃; for 0.116667h; Michael addition; Grinding; neat (no solvent);	99%
With diethyl ether; triethylamine

: 102-96-5
(2-nitroethenyl)benzene

: 507-09-5
thioacetic acid

: 29651-81-8
S-2-nitro-1-phenylethyl thiolacetate

Conditions

Conditions	Yield
With tributyl-amine In diethyl ether for 1h; Michael addition; Cooling with ice;	99%
at 20℃; for 0.0833333h; Michael condensation; neat (no solvent);	98%
With piperidine

: 102-96-5
(2-nitroethenyl)benzene

: 93-91-4
1-phenylbutan-1,3-dione

: 82947-13-5
2-(2-nitro-1-phenylethyl)-1-phenylbutane-1,3-dione

Conditions

Conditions	Yield
With squaramide-containing Dawson organo-polyoxotungstates In dichloromethane for 13h; Reagent/catalyst; Heating;	99%
at 20℃; Michael addition; Neat (no solvent); Grinding; optical yield given as %de;	70%
bis(acetylacetonate)nickel(II) In 1,4-dioxane for 46h; Heating;	60%
With triethylamine In dichloromethane at 20℃; for 24h; Michael Addition;

: 102-96-5
(2-nitroethenyl)benzene

: 2365-48-2
Methyl thioglycolate

: 76665-83-3, 91134-32-6
methyl {[alpha-(nitromethyl)benzyl]thio}acetate

Conditions

Conditions	Yield
With C37H56N4O4; lanthanum(lll) triflate In 1,2-dichloro-ethane at 0℃; for 1h; Sulfa-Michael addition;	99%
With triethylamine In tetrahydrofuran at 20℃; for 2h; Michael addition;	97%
In benzene Heating;

: 102-96-5
(2-nitroethenyl)benzene

: 108-88-3
toluene

: 4099-50-7
N-hydroxy-2-phenyl-2-p-tolylacetimidoyl chloride

Conditions

Conditions	Yield
With aluminum (III) chloride In dichloromethane at 0 - 20℃; Friedel-Crafts alkylation; Inert atmosphere;	99%
With aluminium trichloride

: 102-96-5
(2-nitroethenyl)benzene

: 1099-45-2
ethyl (triphenylphosphoranylidene)acetate

: 37709-90-3
4-Nitro-3-phenyl-2-(triphenyl-λ5-phosphanylidene)-butyric acid ethyl ester

Conditions

Conditions	Yield
In chloroform at 20℃; for 3h; Michael condensation;	99%

: 102-96-5
(2-nitroethenyl)benzene

: 108-98-5
thiophenol

: 4231-84-9
(2-nitro-1-phenylethyl) phenyl sulfide

Conditions

Conditions	Yield
With C23H32F6N4O2S2 In dichloromethane at -40℃; for 1h; Michael Addition;	99%
at 20℃; for 0.116667h; Michael addition; neat (no solvent);	98%
With triethylamine In ethanol at 20℃; for 0.0833333h; Inert atmosphere;	97%

: 1006-94-6
5-methoxylindole

: 102-96-5
(2-nitroethenyl)benzene

: 5-methoxy-3-(2-nitro-1-phenylethyl)-1H-indole

Conditions

Conditions	Yield
With di(naphthalen-1-yl)silanediol In dichloromethane at 23℃; for 48h; Inert atmosphere;	99%
With 2,6-bis(2,2-dimethylpropionylamino)benzoic acid In chloroform at 40℃; for 24h; Friedel-Crafts Alkylation;	99%
With 1,1,1,3',3',3'-hexafluoro-propanol at 20℃; for 2h; Friedel-Crafts Alkylation;	96%

β-NITROSTYRENE Chemical Properties

IUPAC Name: 1-Nitro-2-phenylethylene
The MF of 1-Nitro-2-phenylethylene (102-96-5) is C₈H₇NO₂.

The MW of 1-Nitro-2-phenylethylene (102-96-5) is 149.15.
Synonyms of 1-Nitro-2-phenylethylene (102-96-5): (2-Nitroethenyl)benzene ; trans-beta-Nitrostyrene ; .beta.-Nitrostyrene ; beta-nitrostyrene ; Styrene and beta-nitrostyrene mixture ; Styrene, .beta.-nitro- ; Styrene, .beta.-nitro-, (E)-
Stability: Stable. Combustible. Incompatible with strong oxidizing agents, strong bases. May be sensitive to prolonged exposure to air
Form: Yellow prisms (from ethanol) or yellow crystalline solid
Index of Refraction: 1.603
EINECS: 203-066-0
Density: 1.177 g/ml
Flash Point: 117.5 °C
Boiling Point: 255.8 °C
Melting Point: 55-58 °C
Storage temp: 2-8 °C

β-NITROSTYRENE Toxicity Data With Reference

orl-mus LDLo:710 mg/kg

AECTCV Archives of Environmental Contamination and Toxicology. 14 (1985),111.

β-NITROSTYRENE Consensus Reports

Reported in EPA TSCA Inventory.

β-NITROSTYRENE Safety Profile

Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NO_x.Safety information of 1-Nitro-2-phenylethylene (102-96-5):
Hazard Codes Xi
Risk Statements
36/37/38 Irritating to eyes, respiratory system and skin
Safety Statements
26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36 Wear suitable protective clothing
WGK Germany 3
RTECS WL5460000

Product Name

TRANS-BETA-NITROSTYRENE

Synthetic route

β-NITROSTYRENE Chemical Properties

β-NITROSTYRENE Toxicity Data With Reference

β-NITROSTYRENE Consensus Reports

β-NITROSTYRENE Safety Profile

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