Basic information
- CAS
10081-67-1- Standard SMILES
CC(C)(c1ccccc1)c1ccc(Nc2ccc(C(C)(C)c3ccccc3)cc2)cc1- InChIKey
UJAWGGOCYUPCPS-UHFFFAOYSA-N- Molecular formula
- C30H31N
- Average molar mass
- 405.6 g/mol
- Monoisotopic mass
- 405.24564999
Names & identifiers
- Preferred name
- Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]-
- IUPAC
- 4-(2-phenylpropan-2-yl)-N-[4-(2-phenylpropan-2-yl)phenyl]aniline
- English name
- Bis[4-(2-phenyl-2-propyl)phenyl]amine
- Molecular formula
- C30H31N
- Molecular weight
- 405.57
Names & synonyms
10081-67-14,4'-Bis(alpha,alpha-dimethylbenzyl)diphenylamineEINECS 233-215-5Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]-EC 233-215-54-(1-Methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]anilineBenzenamine, 4-(1-methyl-1-phenylethyl)-N-(4-(1-methyl-1-phenylethyl)phenyl)-4-(1-Methyl-1-phenylethyl)-N-(4-(1-methyl-1-phenylethyl)phenyl)anilineRefChem:561824Benzenamine, 4-(1-methyl-1-phenylethyl)-N-4-(1-methyl-1-phenylethyl)phenyl-233-215-5Bis[4-(2-phenyl-2-propyl)phenyl]amine
Show more names
KY-4054,4'-Bis(α,α-dimethylbenzyl)diphenylamineConnguard 445antioxidantky-405AO-405rianOx 445JADEWIN AN 405Antioxidant 445Antioxidant 4054,4'-Bis(&alpha
Naugard 4454-(2-phenylpropan-2-yl)-n-[4-(2-phenylpropan-2-yl)phenyl]aniline4,4-Bis(alpha,alpha-dimethylbenzyl)diphenylamineMFCD00337918DTXSID00277214,4'-Bis(1,1-dimethylbenzyl)diphenylamine4,4-Bis(|A,|A-dimethylbenzyl)diphenylamine4,4'-Bis(|A,|A-dimethylbenzyl)diphenylamine
Properties
Computed structural properties
- XLogP
- 9.1
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 473
Experimental & physicochemical properties
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical DescriptionLarge Crystals; CBI; Dry Powder
Collision Cross Section220.2 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID0027721]
Physicochemical properties
- Melting point
- 100 °C · 100°C
- Boiling point
- 535.2 · 535.2±39.0 °C(Predicted)
- Density
- 1.061 · 1.061±0.06 g/cm3(Predicted)
- vapor pressure
- 6.67 hPa · 6.67hPa at 20℃
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Practically insoluble in water
- form
- powder to crystal
- pka
- 1.59 · 1.59±0.50(Predicted)
- color
- White to Almost white
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 76.9% (645 of 839) of all reports.
Warning
H317 (21.2%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 839 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]-
Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
REACH registered substance: 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]aniline (EC: 233-215-5)
Benzenamine, 4-(1-methyl-1-phenylethyl)-N-4-(1-methyl-1-phenylethyl)phenyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety InformationIMAP assessments - Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]-: Human health tier I assessment
Hazard Classes and CategoriesSkin Sens. 1 (21.2%)
Safety data
- tsca
- TSCA listed
- hs_code
- 29214990
- risk_code
- 36/37/38-53
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 700,000 - <850,000 lb
Consumer UsesAntioxidant
Industry UsesStabilizing agent
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Benzenamine, 4-(1-methyl-1-phenylethyl)-N-[4-(1-methyl-1-phenylethyl)phenyl]-: ACTIVE
Applications
Description4,4'-Diphenylisopropyl diphenylamine (Antioxidant HS-911) is a kind of high-efficient nontoxic Antioxidant to replace D, A, RD and so on which are carcinogenic. HS-911 can be used in NR, IIR, SBR, NBR, BR, CR and their blend, and is especially efficient in protecting CR from thermal aging. It can also be used in plastic industry. HS-911 not only can protect vulcanized rubber from thermal aging, light aging, ozone aging and damage caused by repeating deformation, but also has a passivating effect on heavy metal and transition metal.
UsesBecause of its light contamination, HS-911 can be used in insulative and protective rubber sheeting for color wires and cables as well as common color rubber products in place of Antioxidant 264, SP, 2264, MB, DNP, etc, to greatly reduce the production cost. In carbon black rubber, it has oxidation resistance of amine type, and will not pollute products. HS-911 can be exclusively used or used together with other Antioxidant . Normal dosage in rubber is 2-3 phr.
Upstream & downstream products
Upstream raw materials
Suppliers100 total
Related reactions
2 records
Compound notes
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