Bis[4-(2-phenyl-2-propyl)phenyl]amine supplier

Name
Bis[4-(2-phenyl-2-propyl)phenyl]amine
EINECS 233-215-5
CAS No. 10081-67-1
Article Data9
CAS DataBase
Density 1.061 g/cm³
Solubility 6.7μg/L at 20℃
Melting Point 100 °C
Formula C₃₀H₃₁N
Boiling Point 535.2 °C at 760 mmHg
Molecular Weight 405.583
Flash Point 292 °C
Transport Information
Appearance white to gray powder
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms Diphenylamine,4,4'-bis(a,a-dimethylbenzyl)- (7CI,8CI);4,4'-Bis(dimethylbenzyl)diphenylamine;4,4'-Bis(a,a-dimethylbenzyl)diphenylamine;4,4'-Bis(a,a'-dimethylbenzyl)diphenylamine;4-(1-Methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]aniline;4-(1-Methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]benzenamine;AO445;Antioxidant 445;Bis(p-cumylphenyl)amine;Bis(phenylisopropylidene)-4,4'-diphenylamine;KY 405;MD 40 (antioxidant);Naugalube AMS;Naugard 445;Nocrac CD;Nonflex DCD;Permanax 49;Permanax 49HV;RDZ;4, 4'-Bis (Alpha, Alpha-Dimethylbenzyl) Diphenylamine;
PSA 12.03000
LogP 8.15500

Synthetic route

: 122-39-4
diphenylamine

: 98-83-9
isopropenylbenzene

A: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

B: 4-(α,α-dimethylbenzyl)diphenylamine

Conditions

Conditions	Yield
With Al-MSU-G at 90℃; for 6h; Product distribution; Further Variations:; Reagents; Temperatures; reaction time;	A 97.2% B n/a
With acid-treated clay catalyst Engelhard F-24 In o-xylene at 89.9℃; for 12h; Product distribution; Irradiation; other alkylating agent, var. catalyst, var. temp, var. solvent, var. time, also without sonication, and in air, also reused catalysts;

...Expand

: 122-39-4
diphenylamine

: 98-83-9
isopropenylbenzene

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

Conditions

Conditions	Yield
With zinc(II) chloride In ethanol; 1,2-dichloro-ethane at 185℃; Solvent; Temperature; Reagent/catalyst; Flow reactor; regioselective reaction;	89%
Stage #1: diphenylamine With tin(ll) chloride; magnesium chloride Heating; Stage #2: isopropenylbenzene at 130 - 140℃; for 1.5h; Reagent/catalyst; Temperature;	85%
With 2-methylbenzene-1,4-diol In toluene at 60 - 125℃; Inert atmosphere;	38.5 g

: 19549-87-2, 127388-21-0, 127388-22-1
2,4-dimethyl-1-heptene

: 90-30-2
N-phenyl-1-naphthylamine

: 122-39-4
diphenylamine

: 98-83-9
isopropenylbenzene

A: 4-nonyldiphenylamine

B: 4-α-methylstyryl-4'-nonyldiphenylamine

C: 4,4'-dinonyldiphenylamine

D: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

E: 4-(α,α-dimethylbenzyl)diphenylamine

Conditions

Conditions	Yield
Stage #1: N-phenyl-1-naphthylamine; diphenylamine; Fulcat 22B at 220℃; under 15.0015 Torr; for 1h; Stage #2: 2,4-dimethyl-1-heptene at 130 - 220℃; for 6.5h; Stage #3: isopropenylbenzene at 130 - 134℃; for 3h; Product distribution / selectivity;

...Expand

: 19549-87-2, 127388-21-0, 127388-22-1
2,4-dimethyl-1-heptene

: 122-39-4
diphenylamine

: 98-83-9
isopropenylbenzene

A: 4-nonyldiphenylamine

B: 4-α-methylstyryl-4'-nonyldiphenylamine

C: 4,4'-dinonyldiphenylamine

D: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

E: 4-(α,α-dimethylbenzyl)diphenylamine

Conditions

Conditions	Yield
Stage #1: 2,4-dimethyl-1-heptene; diphenylamine; Fulcat 22B at 80 - 220℃; under 15.0015 Torr; for 5.5 - 7.5h; Stage #2: isopropenylbenzene at 130 - 134℃; for 3h; Product distribution / selectivity;

...Expand

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: ethyl 10-bromoanthracene-9-carboxylate

: ethyl 10-[bis[4-(1-methyl-1-phenylethyl)phenyl]amino]anthracene-9-carboxylate

Conditions

Conditions	Yield
With tri-tert-butyl phosphine; palladium diacetate; sodium t-butanolate In toluene at 90℃; for 3h; Inert atmosphere;	90%

: 523-27-3
9,10-Dibromoanthracene

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: N9,N9,N10,N10-tetrakis(4-(2-phenylpropan-2-yl)phenyl)anthracene-9,10-diamine

Conditions

Conditions	Yield
With tri-tert-butyl phosphine; palladium diacetate; potassium carbonate In toluene for 10h; Reflux;	80%

: 600-00-0
ethyl 2-bromoisobutyrate

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 3,3-dimethyl-5-(2-phenylpropan-2-yl)-1-(4-(2-phenylpropan-2-yl)phenyl)indolin-2-one

Conditions

Conditions	Yield
With [2,2]bipyridinyl; copper diacetate; potassium carbonate In acetonitrile at 120℃; for 12h; Schlenk technique; Inert atmosphere;	80%

: 2-bromospiro[fluorenyl-9,8'-indolo[3,2,1-de]acridine]

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: C61H48N2

Conditions

Conditions	Yield
With bis(tri-t-butylphosphine)palladium(0); sodium t-butanolate In 5,5-dimethyl-1,3-cyclohexadiene for 3h; Inert atmosphere; Heating;	70%

: 56961-77-4
1-bromo-2,3-dichlorobenzene

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: C66H63ClN2

Conditions

Conditions	Yield
With tris-(dibenzylideneacetone)dipalladium(0); sodium t-butanolate at 130℃; Inert atmosphere;	66.2%

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 350-46-9
4-Fluoronitrobenzene

: 1243278-12-7
bis[4-(2-phenyl-2-isopropyl)phenyl]-4-nitrophenylamine

Conditions

Conditions	Yield
With sodium hydride In dimethyl sulfoxide at 120℃; for 24h;	63%
With sodium hydride In dimethyl sulfoxide at 120℃; for 48h;	50%
With sodium hydride In dimethyl sulfoxide at 120℃; for 48h;	50%

: 106-37-6
1.4-dibromobenzene

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 1310961-36-4
N-(4-bromophenyl)-4-(2-phenylpropan-2-yl)-N-(4-(2-phenylpropan-2-yl)phenyl)benzeneamine

Conditions

Conditions	Yield
With 1,1'-bis-(diphenylphosphino)ferrocene; palladium diacetate; sodium t-butanolate In toluene at 120℃; for 7h; Inert atmosphere;	62%

: 591-50-4
iodobenzene

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 259218-10-5
C36H35N

Conditions

Conditions	Yield
With 1,1'-bis-(diphenylphosphino)ferrocene; bis(dibenzylideneacetone)-palladium(0); sodium t-butanolate In toluene for 8h; Buchwald-Hartwig reaction; Reflux; Inert atmosphere;	55%
With 1,1'-bis-(diphenylphosphino)ferrocene; bis(dibenzylideneacetone)-palladium(0); sodium t-butanolate In toluene for 8h; Inert atmosphere; Reflux;	55%

: 406-93-9
4,4,4-trifluorobutyric acid

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 4-(2-phenylpropan-2-yl)-N-(4-(2-phenylpropan-2-yl)phenyl)-N-(3,3,3-trifluoropropyl)aniline

Conditions

Conditions	Yield
With di-tert-butyl peroxide; copper(II) hexafluoroacetylacetonate; 9-mesitylacridine at 35℃; for 24h; Inert atmosphere; Irradiation;	51%

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 312924-97-3
7-bromo-10-hexyl-10H-phenothiazine-3-carbaldehyde

: 1618093-71-2
7-(bis(4-(2-phenylpropan-2-yl)phenyl)amino)-10-hexyl-10H-phenothiazine-3-carbaldehyde

Conditions

Conditions	Yield
With tri-tert-butyl phosphine; potassium tert-butylate; palladium diacetate In toluene Reflux; Inert atmosphere;	45%

: 558-13-4
carbon tetrabromide

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 2,7-bis(1-methyl-1-phenylethyl)-N,N-bis[4-(1-methyl-1-phenylethyl)phenyl]acridin-9-amine

Conditions

Conditions	Yield
In toluene at 20℃; Rate constant; Irradiation; photoinduced reaction of diarylamines with CBr4; spectral study; intermediates formation; spectral and kinetic properties of intermediates;
In toluene at 20℃; Irradiation;
In hexane Irradiation;

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 1243278-16-1
BBTPA

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: sodium hydride / dimethyl sulfoxide / 48 h / 120 °C 2: palladium on activated charcoal; hydrazine hydrate / 12 h / Reflux; Inert atmosphere 3: 1,1'-bis-(diphenylphosphino)ferrocene; bis(dibenzylideneacetone)-palladium(0); sodium t-butanolate / toluene / 10 h / Reflux; Inert atmosphere View Scheme

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 1243278-14-9
bis[4-(2-phenyl-2-isopropyl)phenyl]-4-aminophenylamine

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: sodium hydride / dimethyl sulfoxide / 48 h / 120 °C 2: palladium on activated charcoal; hydrazine hydrate / 12 h / Reflux; Inert atmosphere View Scheme
Multi-step reaction with 2 steps 1: sodium hydride / dimethyl sulfoxide / 48 h / 120 °C 2: hydrazine hydrate / palladium 10% on activated carbon / ethanol / 90 °C View Scheme
Multi-step reaction with 2 steps 1: sodium hydride / dimethyl sulfoxide / 24 h / 120 °C 2: palladium on activated charcoal; hydrazine hydrate / ethanol / 12 h / Reflux View Scheme

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 1246049-04-6
N,N-bis(4-nitrophenyl)-N',N'-bis[4-(2-phenyl-2-isopropyl)phenyl]-1,4-phenylenediamine

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: sodium hydride / dimethyl sulfoxide / 48 h / 120 °C 2: hydrazine hydrate / palladium 10% on activated carbon / ethanol / 90 °C 3: cesium fluoride / dimethyl sulfoxide / 24 h / 120 °C View Scheme
Multi-step reaction with 3 steps 1: sodium hydride / dimethyl sulfoxide / 24 h / 120 °C 2: palladium on activated charcoal; hydrazine hydrate / ethanol / 12 h / Reflux 3: cesium fluoride / dimethyl sulfoxide / 24 h / 120 °C View Scheme

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 1246048-80-5
N,N-bis(4-aminophenyl)-N',N'-bis[4-(2-phenyl-2-isopropyl)phenyl]-1,4-phenylenediamine

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: sodium hydride / dimethyl sulfoxide / 48 h / 120 °C 2: hydrazine hydrate / palladium 10% on activated carbon / ethanol / 90 °C 3: cesium fluoride / dimethyl sulfoxide / 24 h / 120 °C 4: hydrazine / palladium 10% on activated carbon / ethanol / 90 °C View Scheme
Multi-step reaction with 4 steps 1: sodium hydride / dimethyl sulfoxide / 24 h / 120 °C 2: palladium on activated charcoal; hydrazine hydrate / ethanol / 12 h / Reflux 3: cesium fluoride / dimethyl sulfoxide / 24 h / 120 °C 4: palladium on activated charcoal; hydrazine hydrate / ethanol / 12.5 h / 90 °C / Reflux View Scheme

: 106-37-6
1.4-dibromobenzene

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: C80H79N3

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: 1,1'-bis-(diphenylphosphino)ferrocene; palladium diacetate; sodium t-butanolate / toluene / 7 h / 120 °C / Inert atmosphere 2: 1,1'-bis-(diphenylphosphino)ferrocene; tri-tert-butyl phosphine; palladium diacetate; sodium t-butanolate / toluene / 5 h / 110 °C / Inert atmosphere View Scheme

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 1350319-91-3
C39H33N3O2S

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: sodium t-butanolate; tri-tert-butyl phosphine; palladium diacetate / toluene; icosane / 2 h 2: acetonitrile / 4 h / 20 °C View Scheme

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 1350319-92-4
C45H43N3O4S

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: sodium t-butanolate; tri-tert-butyl phosphine; palladium diacetate / toluene; icosane / 2 h 2: acetonitrile / 4 h / 20 °C 3: potassium carbonate / acetonitrile / 2 h / 80 °C View Scheme

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 1350319-94-6
C41H35N3O4S

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: sodium t-butanolate; tri-tert-butyl phosphine; palladium diacetate / toluene; icosane / 2 h 2: acetonitrile / 4 h / 20 °C 3: potassium carbonate / acetonitrile / 2 h / 80 °C 4: toluene-4-sulfonic acid / toluene / 4 h / 80 °C View Scheme

: 1003-09-4
2-bromothiophene

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 1350319-90-2
C34H33NS

Conditions

Conditions	Yield
With tri-tert-butyl phosphine; palladium diacetate; sodium t-butanolate In icosane; toluene for 2h;	43.3 g

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: 312924-97-3
7-bromo-10-hexyl-10H-phenothiazine-3-carbaldehyde

: 1618093-69-8
3-(7-(bis(4-(2-phenylpropan-2-yl)phenyl)amino)-10-hexyl-10H-phenothiazin-3-yl)-2-cyanoacrylic acid

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: palladium diacetate; tri-tert-butyl phosphine; potassium tert-butylate / toluene / Reflux; Inert atmosphere 2: piperidine / acetonitrile; chloroform / 10 h / Reflux View Scheme

: 67843-74-7
(S)-epichlorohydrin

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: C33H36ClNO

Conditions

Conditions	Yield
With acetic acid at 60 - 65℃; for 48h;

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: (R)-3-(4,4'-bis(α,α-dimethylbenzyl))diphenylaminopropene oxide

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: acetic acid / 48 h / 60 - 65 °C 2: sodium hydroxide / diethyl ether / 2 h / Reflux View Scheme

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: (S)-3-(4,4'-bis(α,α-dimethylbenzyl))diphenylaminopropene oxide

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: acetic acid / 48 h / 60 - 65 °C 2: sodium hydroxide / diethyl ether / 2 h / Reflux View Scheme

: 51594-55-9
(R)-(-)-epichlorohydrin

: 10081-67-1
bis[4-(2-phenyl-2-propyl)phenyl]amine

: C33H36ClNO

Conditions

Conditions	Yield
With acetic acid at 60 - 65℃; for 48h;

Bis[4-(2-phenyl-2-propyl)phenyl]amine Specification

The IUPAC name of Benzenamine,4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]- is 4-(2-phenylpropan-2-yl)-N-[4-(2-phenylpropan-2-yl)phenyl]aniline. With the CAS registry number 10081-67-1, it is also named as Diphenylamine, 4,4'-bis(alpha,alpha-dimethylbenzyl)-. The product's categories are Industrial/Fine Chemicals; Organics, and the other registry numbers are 108192-80-9; 125053-82-9. Besides, it should be stored in a closed containers in a cool and dry place. In addition, its molecular formula is C₃₀H₃₁N and molecular weight is 405.58.

The other characteristics of Benzenamine,4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]- can be summarized as: (1)ACD/LogP: 8.34; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.34; (4)ACD/LogD (pH 7.4): 8.34; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 820784.06; (8)ACD/KOC (pH 7.4): 820883.19; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 3.24 Å²; (13)Index of Refraction: 1.607; (14)Molar Refractivity: 131.93 cm³; (15)Molar Volume: 382 cm³; (16)Polarizability: 52.3×10^-24cm³; (17)Surface Tension: 40.8 dyne/cm; (18)Density: 1.061 g/cm³; (19)Flash Point: 292 °C; (20)Enthalpy of Vaporization: 81.15 kJ/mol; (21)Boiling Point: 535.2 °C at 760 mmHg; (22)Vapour Pressure: 1.58E-11 mmHg at 25 °C.

Preparation and Uses of Benzenamine,4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]-: the main use of this chemical is for the non-polluting amines antiager. And this chemical can be prepared by N-phenylaniline and 2-Phenyl-1-propene. This reaction will need catalyst activatedclay.

When you are using this chemical, please be cautious about it as the following: it irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

People can use the following data to convert to the molecule structure.
(1)SMILES: c3c(Nc1ccc(cc1)C(c2ccccc2)(C)C)ccc(c3)C(c4ccccc4)(C)C
(2)InChI: InChI=1/C30H31N/c1-29(2,23-11-7-5-8-12-23)25-15-19-27(20-16-25)31-28-21-17-26(18-22-28)30(3,4)24-13-9-6-10-14-24/h5-22,31H,1-4H3
(3)InChIKey: UJAWGGOCYUPCPS-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C30H31N/c1-29(2,23-11-7-5-8-12-23)25-15-19-27(20-16-25)31-28-21-17-26(18-22-28)30(3,4)24-13-9-6-10-14-24/h5-22,31H,1-4H3
(5)Std. InChIKey: UJAWGGOCYUPCPS-UHFFFAOYSA-N

Product Name

Bis[4-(2-phenyl-2-propyl)phenyl]amine

Synthetic route

Bis[4-(2-phenyl-2-propyl)phenyl]amine Specification

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