1H-Pyrrole, 2-phenyl- supplier

Name
2-PHENYLPYRROLE
EINECS 1592732-453-0
CAS No. 3042-22-6
Article Data145
CAS DataBase
Density 1.076 g/cm³
Solubility
Melting Point 130℃
Formula C₁₀H₉N
Boiling Point 302.4 °C at 760 mmHg
Molecular Weight 143.188
Flash Point 124.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Pyrrole,2-phenyl- (6CI,7CI,8CI);2-Phenyl-1H-pyrrole;2-Phenylpyrrole;NSC 94963;2-phenyl-1H-pyrrole;
PSA 15.79000
LogP 2.68170

Synthetic route

: 199276-69-2
(4-azidobut-1-yn-1-yl)benzene

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With trifluorormethanesulfonic acid; phenylmercuric acetate In nitromethane at 20℃; for 0.0833333h; Inert atmosphere;	99%
With 2,6-di-tert-butyl-4-methylpyridine; platinum(IV) chloride In ethanol for 6h; Heating;	74%
With silver hexafluoroantimonate; (bis(diphenylphosphino)methane)bis(chlorogold(I)) In dichloromethane at 35℃; Schmidt reaction;	68%

: 56139-59-4
4-oxo-4-phenyl-butyraldehyde

: 100-46-9
benzylamine

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With acetic acid In methanol at 20℃; for 2h; Inert atmosphere; Molecular sieve;	99%

: 3-iodo-2-phenylpyrrole

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With zinc In ethanol for 16h; Inert atmosphere; Reflux;	99%

: 132868-20-3
6-Phenoxy-3-phenyl-5,6-dihydro-4H-[1,2]oxazine

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With triiron dodecarbonyl In 1,2-dichloro-ethane at 80℃; for 20h;	98%

: 85868-20-8
O-Vinylacetophenonoxime

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With potassium hydroxide; dimethyl sulfoxide at 95℃; for 1.33333h;	96%

: 2-(2-phenyl-1H-pyrrol-1-yl)pyrimidine

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With sodium ethanolate In dimethyl sulfoxide at 100℃; for 24h;	94%

: 591-50-4
iodobenzene

: 2-(Methoxy-dimethyl-silanyl)-1-methyl-1H-pyrrole

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With copper(l) iodide; sodium pentafluorophenolate In various solvent(s) at 130℃; for 12h;	93%

: ((1E,3E)-4-azidobuta-1,3-dien-1-yl)benzene

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With tris-(4,4’-di-tert-butyl-2,2’-bipyridine)ruthenium(II) hexafluorophosphate In chloroform at 20℃; for 3h; Concentration; Schlenk technique; Inert atmosphere; Irradiation;	93%

: 132868-21-4
6-butoxy-3-phenyl-1,2-oxazine

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With triiron dodecarbonyl In 1,2-dichloro-ethane at 80℃; for 20h;	91%

: 109-97-7
pyrrole

: 591-50-4
iodobenzene

A: 3042-22-6
2-phenyl-1H-pyrrole

B: 27649-43-0
3-phenyl-1H-pyrrole

Conditions

Conditions	Yield
Stage #1: pyrrole With sodium hydride In tetrahydrofuran Stage #2: iodobenzene With zinc(II) chloride; johnphos; palladium diacetate In tetrahydrofuran at 100℃; for 21h;	A 91% B n/a
With potassium tert-butylate In dimethyl sulfoxide at 80℃; for 22h; Sealed tube; Inert atmosphere; regioselective reaction;

...Expand

: 700-91-4
2-phenyl-1-pyrroline

A: 3042-22-6
2-phenyl-1H-pyrrole

B: 13214-66-9
4-phenyl-1-butylamine

Conditions

Conditions	Yield
With [10%-Pd/Al2O3] In 5,5-dimethyl-1,3-cyclohexadiene at 150℃; for 1.5h; Kinetics; Reagent/catalyst; Time; Concentration; Inert atmosphere;	A 90% B n/a
With [10%-Pd/Al2O3] In 5,5-dimethyl-1,3-cyclohexadiene at 150℃; for 2h;	A 79% B n/a

: 161564-59-6
acetophenone O-vinyloxime

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With potassium tert-butylate In tert-butyl alcohol for 5h; Heating;	89%

: 109-97-7
pyrrole

: 591-50-4
iodobenzene

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With palladium diacetate; magnesium oxide; triphenylphosphine In 1,4-dioxane at 150℃;	86%
With [Rh(coe)2Cl]2; tris(para-trifluoromethyl)phenyl phosphine In 1,4-dioxane at 120℃;	78%
With C52H44CoN4O4; potassium hydroxide; tert-butyl alcohol at 200℃; for 0.5h; Inert atmosphere; Darkness; regioselective reaction;	69%

: 591-50-4
iodobenzene

: 135884-31-0
N-boc-2-pyrroleboronic acid

A: 3042-22-6
2-phenyl-1H-pyrrole

B: 163525-97-1
tert-butyl 2-phenyl-1H-pyrrole-1-carboxylate

Conditions

Conditions	Yield
With methanol; tetrakis(triphenylphosphine) palladium(0); caesium carbonate In toluene for 24h; Suzuki coupling; Reflux; Inert atmosphere;	A 7% B 86%

...Expand

: 1616603-16-7
1-phenylbut-3-en-1-one acetyloxime

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With copper(I) bromide In toluene at 120℃; Solvent; Reagent/catalyst; Inert atmosphere;	86%

: 120256-08-8
Dimethyl-(2-phenyl-pyrrol-1-yl)-amine

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With hydrogen; nickel In methanol; water under 3102.9 Torr; for 48h; Ambient temperature;	85%

: 58042-93-6
2-phenyl-1-vinyl-1H-pyrrole

: 71-36-3
butan-1-ol

A: 3042-22-6
2-phenyl-1H-pyrrole

B: 76892-15-4
N-(α-butoxyethyl)-2-phenylpyrrole

Conditions

Conditions	Yield
With ferric nitrate In water at 50℃; for 20h; Title compound not separated from byproducts;	A 10% B 85%
With ferric nitrate In water at 50℃; for 20h; Yield given. Yields of byproduct given. Title compound not separated from byproducts;
With ferric nitrate In water; butan-1-ol at 50℃; for 20h; Product distribution;	A 10 % Chromat. B 85 % Chromat.
ferric nitrate In water at 50℃; for 20h; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

...Expand

: 1616603-33-8
C13H15NO2

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With copper(I) bromide In toluene at 120℃; Inert atmosphere;	84%

: 1616603-34-9
C15H19NO2

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With copper(I) bromide In toluene at 120℃; Inert atmosphere;	82%

: 80288-27-3
(2E,4Z)-6-Azido-3-phenyl-hexa-2,4-dienoic acid ethyl ester

A: 3042-22-6
2-phenyl-1H-pyrrole

B: 80288-31-9
ethyl α-diazo-2-phenyl-2,5-dihydropyrrole-2-acetate

Conditions

Conditions	Yield
With acetic acid In diethyl ether for 36h; Ambient temperature;	A 80% B n/a
In benzene at 55℃; for 1.5h;	A n/a B 25%

: trans-2-(tributylstannyl)-N,N-dibenzylcyclopropylamine

: 100-47-0
benzonitrile

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
Stage #1: trans-2-(tributylstannyl)-N,N-dibenzylcyclopropylamine; benzonitrile With n-butyllithium In tetrahydrofuran; hexane at -30 - 0℃; for 2.5h; Stage #2: With acetic acid In tetrahydrofuran; hexane	80%

: 1616603-35-0
1-phenylbut-3-en-1-one O-benzoyl oxime

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With copper(I) bromide In toluene at 120℃; Inert atmosphere;	80%

: 613-91-2
acetophenone oxime

: 74-86-2
acetylene

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With potassium hydroxide In dimethyl sulfoxide at 150℃; for 6h;	79%
With potassium hydroxide In dimethyl sulfoxide at 150℃; for 4h;	44%
Trofimov reaction;
In dimethyl sulfoxide Alkaline conditions;

: 109-97-7
pyrrole

: 66003-76-7
Diphenyliodonium triflate

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With sodium hydroxide at 80℃; for 10h; under air;	78%
Inert atmosphere; Schlenk technique;	74%
With sodium hydroxide at 80℃; for 10h; Inert atmosphere; Schlenk technique;	70%
With sodium hydroxide at 80℃; Schlenk technique; Inert atmosphere;	69%
With palladium diacetate; acetic acid at 20℃; for 15h;

: 109-97-7
pyrrole

: diphenyliodonium tetrafluoroborate

A: 3042-22-6
2-phenyl-1H-pyrrole

B: 591-50-4
iodobenzene

Conditions

Conditions	Yield
With sodium hydroxide at 80℃; for 10h; under air; regioselective reaction;	A 78% B n/a

...Expand

: 109-97-7
pyrrole

: 66003-76-7
Diphenyliodonium triflate

A: 3042-22-6
2-phenyl-1H-pyrrole

B: 591-50-4
iodobenzene

Conditions

Conditions	Yield
With sodium hydroxide at 80℃; for 10h; under air; regioselective reaction;	A 78% B n/a

...Expand

: 109-97-7
pyrrole

: 1483-73-4
diphenyliodonium bromide

A: 3042-22-6
2-phenyl-1H-pyrrole

B: 591-50-4
iodobenzene

Conditions

Conditions	Yield
With sodium hydroxide at 80℃; for 10h; under air; regioselective reaction;	A 77% B n/a

...Expand

: 117657-37-1
2-bromo-pyrrole-1-carboxylic acid tert-butyl ester

: 98-80-6
phenylboronic acid

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
Stage #1: 2-bromo-pyrrole-1-carboxylic acid tert-butyl ester; phenylboronic acid With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium carbonate In ethanol; water; toluene at 110℃; for 12h; Sealed tube; Inert atmosphere; Stage #2: With potassium carbonate In methanol for 12h; Inert atmosphere; Reflux;	77%

: 161958-62-9
2-phenyl-1H-pyrrole-4-carboxylic acid

: 3042-22-6
2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With ethanolamine for 2h; Heating;	75%

: N-(4-chlorophenyl)-2-phenyl-5-(2-phenyl-1H-pyrrol-1-yl)isoxazolidine-3-carboxamide

A: 3042-22-6
2-phenyl-1H-pyrrole

B: 1-(4-chlorophenyl)-5-hydroxy-3-(phenylamino)-1,5-dihydro-2H-pyrrol-2-one

Conditions

Conditions	Yield
With tetrabutyl ammonium fluoride In tetrahydrofuran at 20℃; for 4h; Inert atmosphere;	A n/a B 75%

: 3042-22-6
2-phenyl-1H-pyrrole

: 78115-49-8
2,3-dihydro-3-methylene-4H-benzopyran-4-one

: C20H17NO2

Conditions

Conditions	Yield
With C45H55O4P In dichloromethane at -65℃; for 12h; Inert atmosphere; enantioselective reaction;	99%

: 3042-22-6
2-phenyl-1H-pyrrole

: 126597-34-0
1-p-hydroxyphenyl-1-phenyl-1-ethanol

: (S)-4-(1-phenyl-1-(5-phenyl-1H-pyrrol-2-yl)ethyl)phenol

Conditions

Conditions	Yield
With (11aS)-3,7-di-9-anthracenyl-10,11,12,13-tetrahydro-5-hydroxy-5-oxide diindeno[7,1de:10,70-fg][1,3,2] dioxaphosphocin In chloroform at 0 - 20℃; for 48h; Molecular sieve; enantioselective reaction;	97%

: 3042-22-6
2-phenyl-1H-pyrrole

: 2,6-dimethyl-4-(2,2,2-trifluoro-1-phenylethylidene)cyclohexa-2,5-dienone

: 2,6-dimethyl-4-(2,2,2-trifluoro-1-phenyl-1-(5-phenyl-1H-pyrrol-2-yl)ethyl)phenol

Conditions

Conditions	Yield
With bismuth(lll) trifluoromethanesulfonate In dichloromethane at 20℃; for 0.0333333h;	97%

: 3042-22-6
2-phenyl-1H-pyrrole

: 74-86-2
acetylene

: 58042-93-6
2-phenyl-1-vinyl-1H-pyrrole

Conditions

Conditions	Yield
With potassium hydroxide In dimethyl sulfoxide at 110℃; under 735.5 Torr; for 4.5h; Product distribution; different temperature and time;	96%
With potassium hydroxide In dimethyl sulfoxide at 120℃; under 735.5 Torr; for 6h;	96%
With potassium hydroxide In dimethyl sulfoxide at 100℃; Product distribution; various 2-, 2,3-, and 2,5-substituted pyrroles; various times;
With potassium hydroxide; benzophenone In dimethyl sulfoxide at 100℃; Product distribution; Mechanism; other pyrrole; other reagents;
With potassium hydroxide; t-butylnitrite at 20℃; Mechanism; other 2-arylpyrroles; other acetylenes;

: 3042-22-6
2-phenyl-1H-pyrrole

: 68-12-2, 33513-42-7
N,N-dimethyl-formamide

: 52179-74-5
5-phenyl-1H-pyrrole-2-carbaldehyde

Conditions

Conditions	Yield
Stage #1: 2-phenyl-1H-pyrrole; N,N-dimethyl-formamide With trichlorophosphate In toluene at 20℃; Vilsmeier-Haack Formylation; Cooling with ice; Inert atmosphere; Stage #2: With water; sodium hydrogencarbonate; sodium hydroxide In toluene at 0℃; for 3h; pH=7 - 12; Vilsmeier-Haack Formylation; Inert atmosphere;	96%
Stage #1: 2-phenyl-1H-pyrrole; N,N-dimethyl-formamide With trichlorophosphate at 0 - 40℃; for 1.16667h; Inert atmosphere; Stage #2: With water; sodium hydroxide for 0.5h; Reflux;
Stage #1: N,N-dimethyl-formamide With trichlorophosphate In dichloromethane for 0.0833333h; Vilsmeier-Haack Formylation; Inert atmosphere; Stage #2: 2-phenyl-1H-pyrrole In dichloromethane Vilsmeier-Haack Formylation; Inert atmosphere; Stage #3: With sodium hydroxide In tetrahydrofuran at 23℃; Vilsmeier-Haack Formylation; Inert atmosphere; regioselective reaction;	139 mg

: 3042-22-6
2-phenyl-1H-pyrrole

: 1447004-26-3
1-(5-[1,1-biphenyl]-4-yl-1H-pyrrol-2-yl)-2,2,2-trifluoro-1-ethanol

: 1447031-59-5
2-[1,1-biphenyl]-4-yl-5-[2,2,2-trifluoro-1-(5-phenyl-1H-pyrrol-2-yl)-ethyl]-1H-pyrrole

Conditions

Conditions	Yield
With phosphorus pentoxide In dichloromethane at 20℃; for 16h; Inert atmosphere;	96%

: 3042-22-6
2-phenyl-1H-pyrrole

: 653-37-2
perfluorobenzaldehyde

: 5-pentafluorophenyl-1,9-diphenyldipyrrin

Conditions

Conditions	Yield
Stage #1: 2-phenyl-1H-pyrrole; perfluorobenzaldehyde With trifluoroacetic acid In dichloromethane at 20℃; for 3h; Stage #2: With 2,3-dicyano-5,6-dichloro-p-benzoquinone In dichloromethane at 20℃; for 0.5h; Inert atmosphere;	95%

: 350-03-8
methyl-3-pyridylketone

: 3042-22-6
2-phenyl-1H-pyrrole

: 1149-23-1
diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

: 1604834-30-1
C17H18N2O

Conditions

Conditions	Yield
With (11aR)-10,11,12,13-tetrahydro-5-hydroxy-3,7-bis[2,4,6-triisopropylphenyl]-5-oxide-diindeno[7,1-de:1',7’-fg][1,3,2]dioxaphosphocin In dichloromethane at 20℃; for 72h; Inert atmosphere; Schlenk technique; Molecular sieve; enantioselective reaction;	94%

...Expand

: 3042-22-6
2-phenyl-1H-pyrrole

: C11H14F3NO

: C21H21F3N2

Conditions

Conditions	Yield
With phosphorus pentoxide In dichloromethane at 20℃; for 16h;	94%

: 3042-22-6
2-phenyl-1H-pyrrole

: 91574-67-3, 91574-68-4, 20766-37-4
2-chlorobenzalacetone

: (S)-4-(2-chlorophenyl)-4-(5-phenyl-1H-pyrrol-2-yl)butan-2-one

Conditions

Conditions	Yield
With 9-amino-9-deoxy-epi-cinchonidine; trifluoroacetic acid In chlorobenzene at 20℃; for 24h; Michael Addition; enantioselective reaction;	93%

: 3042-22-6
2-phenyl-1H-pyrrole

: 14548-45-9
(4-bromophenyl)(pyridin-3-yl)methanone

: 1149-23-1
diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

: 1604834-22-1
C22H19BrN2O

Conditions

Conditions	Yield
With (11aR)-10,11,12,13-tetrahydro-5-hydroxy-3,7-bis[2,4,6-triisopropylphenyl]-5-oxide-diindeno[7,1-de:1',7’-fg][1,3,2]dioxaphosphocin In dichloromethane at 20℃; for 60h; Inert atmosphere; Schlenk technique; Molecular sieve; enantioselective reaction;	93%

...Expand

: 3042-22-6
2-phenyl-1H-pyrrole

: 64995-46-6
3-(trifluoromethyl)-2H-benzo[b][1,4]oxazin-2-one

: C19H13F3N2O2

Conditions

Conditions	Yield
With (11aR)-10,11,12,13-tetrahydro-5-hydroxy-3,7-bis[2,4,6-triisopropylphenyl]-5-oxide-diindeno[7,1-de:1',7’-fg][1,3,2]dioxaphosphocin In toluene at 20℃; for 12h; Friedel-Crafts Alkylation; enantioselective reaction;	93%

: 3042-22-6
2-phenyl-1H-pyrrole

: 17784-47-3
acridine hydrochloride

: 9-(5-phenyl-1H-pyrrol-2-yl)acridinium chloride

Conditions

Conditions	Yield
With CdS/TiO2; oxygen In butan-1-ol at 20℃; for 5h; Irradiation;	92%

: 3042-22-6
2-phenyl-1H-pyrrole

: C10H6F3NO2

: (R)-7-methyl-3-(5-phenyl-1H-pyrrol-2-yl)-3-(trifluoromethyl)-3,4-dihydro-2H-benzo[b][1,4]oxazin-2-one

Conditions

Conditions	Yield
With (R)-6,6'-bis(2,4,6-triisopropylphenyl)-1,1'-spirobiindanyl-7,7'-diyl hydrogen phosphate In toluene at 20℃; for 18h; Friedel-Crafts Alkylation; Inert atmosphere; enantioselective reaction;	91%

: 3042-22-6
2-phenyl-1H-pyrrole

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

: 3-(2-nitro-1-phenylethyl)-2-phenyl-1H-pyrrole

Conditions

Conditions	Yield
With 2,2,2-trifluoroacetic acid ammonia In ethanol; water at 115℃;	91%

: 3042-22-6
2-phenyl-1H-pyrrole

: 6-fluoro-3-trifluoromethyl-benzoxazinone

: (R)-6-fluoro-3-(5-phenyl-1H-pyrrol-2-yl)-3-(trifluoromethyl)-3,4-dihydro-2H-benzo[b][1,4]oxazin-2-one

Conditions

Conditions	Yield
With (R)-6,6'-bis(2,4,6-triisopropylphenyl)-1,1'-spirobiindanyl-7,7'-diyl hydrogen phosphate In toluene at 20℃; for 18h; Friedel-Crafts Alkylation; Inert atmosphere; enantioselective reaction;	90%

: 3042-22-6
2-phenyl-1H-pyrrole

: 64995-54-6
6-chloro-3-trifluoromethyl-benzoxazinone

: (R)-6-chloro-3-(5-phenyl-1H-pyrrol-2-yl)-3-(trifluoromethyl)-3,4-dihydro-2H-benzo[b][1,4]oxazin-2-one

Conditions

Conditions	Yield
With (S)-3,3'-bis(2,4,6-tri-iso-propylphenyl)-1,1'-binaphthyl-2,2'-diyl hydrogenphosphate In toluene at 20℃; for 18h; Friedel-Crafts Alkylation; Inert atmosphere; enantioselective reaction;	90%

: 3042-22-6
2-phenyl-1H-pyrrole

: (E)-2-((6-chlorohex-2-en-1-yl)oxy)tetrahydro-2H-pyran

: (E)-2-phenyl-1-(6-((tetrahydro-2H-pyran-2-yl)oxy)hex-4-en-1-yl)-1H-pyrrole

Conditions

Conditions	Yield
Stage #1: 2-phenyl-1H-pyrrole With sodium hydride In N,N-dimethyl-formamide; paraffin oil at 25 - 28℃; for 0.5h; Stage #2: (E)-2-((6-chlorohex-2-en-1-yl)oxy)tetrahydro-2H-pyran In N,N-dimethyl-formamide; paraffin oil at 0 - 28℃; for 24h;	90%

: 3042-22-6
2-phenyl-1H-pyrrole

: 2-(4-oxocyclohexa-2,5-dien-1-ylidene)-2-phenylacetonitrile

: 2-(4-hydroxyphenyl)-2-phenyl-2-(5-phenyl-1H-pyrrol-2-yl)acetonitrile

Conditions

Conditions	Yield
With bismuth(lll) trifluoromethanesulfonate In dichloromethane at 20℃; for 12h;	90%

1H-Pyrrole, 2-phenyl- Specification

The 1H-Pyrrole, 2-phenyl-, with the CAS registry number 3042-22-6, has the systematic name of 2-phenyl-1H-pyrrole. It is also called 2-Phenylpyrrole, and its code classification is Drug/Therapeutic Agent. And the molecular formula of this chemical is C₁₀H₉N.

The physical properties of 1H-Pyrrole, 2-phenyl- are as followings: (1)ACD/LogP: 2.76; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.76; (4)ACD/LogD (pH 7.4): 2.76; (5)ACD/BCF (pH 5.5): 73.72; (6)ACD/BCF (pH 7.4): 73.72; (7)ACD/KOC (pH 5.5): 755.86; (8)ACD/KOC (pH 7.4): 755.86; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 4.93 Å²; (13)Index of Refraction: 1.596; (14)Molar Refractivity: 45.27 cm³; (15)Molar Volume: 133 cm³; (16)Polarizability: 17.94×10^-24cm³; (17)Surface Tension: 42.7 dyne/cm; (18)Density: 1.076 g/cm³; (19)Flash Point: 124.6 °C; (20)Enthalpy of Vaporization: 52.09 kJ/mol; (21)Boiling Point: 302.4 °C at 760 mmHg; (22)Vapour Pressure: 0.00178 mmHg at 25°C.

Uses of 1H-Pyrrole, 2-phenyl-: It can react with 1,2,3-trichloro-propane to produce 1-propadienyl-2-phenylpyrrole. This reaction will need reagent KOH, and the solvent dimethylsulfoxide. The reaction time is 20 minutes with temperature of 40°C, and the yield is about 2.8g.

1H-Pyrrole, 2-phenyl- can react with 1,2,3-trichloro-propane to produce 1-propadienyl-2-phenylpyrrole

You can still convert the following datas into molecular structure:
(1)SMILES: c2ccc(c1cccn1)cc2
(2)InChI: InChI=1/C10H9N/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-8,11H
(3)InChIKey: IRTLROCMFSDSNF-UHFFFAOYAN

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	533mg/kg (533mg/kg)	BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)	Journal of Medicinal Chemistry. Vol. 11, Pg. 1251, 1968.

Product Name

2-PHENYLPYRROLE

Synthetic route

1H-Pyrrole, 2-phenyl- Specification

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