4,4'-Methylenebis(2-((4-aminophenyl)methyl)aniline)
Basic information
- CAS
65086-99-9- Standard SMILES
Nc1ccc(Cc2cc(Cc3ccc(N)c(Cc4ccc(N)cc4)c3)ccc2N)cc1- InChIKey
BCYHURLIXRJERG-UHFFFAOYSA-N- Molecular formula
- C27H28N4
- Average molar mass
- 408.5 g/mol
- Monoisotopic mass
- 408.23139691
Names & identifiers
- Preferred name
- 4,4'-Methylenebis(2-((4-aminophenyl)methyl)aniline)
- IUPAC
- 4-[[4-amino-3-[(4-aminophenyl)methyl]phenyl]methyl]-2-[(4-aminophenyl)methyl]aniline
- English name
- 4,4'-methylenebis[2-[(4-aminophenyl)methyl]aniline]
- Molecular formula
- C27H28N4
- Molecular weight
- 408.54
Names & synonyms
EINECS 265-389-3V4YYC47ZP6Benzenamine, 4,4'-methylenebis[2-[(4-aminophenyl)methyl]-Benzenamine, 4,4'-methylenebis(2-((4-aminophenyl)methyl)-DTXSID10701934,4'-Methylenebis(2-((4-aminophenyl)methyl)aniline)4,4'-Methylenebis[2-[(4-aminophenyl)methyl]aniline]4,4'-METHYLENEBIS(2-((4-AMINOPHENYL)METHYLBENZENAMINE4,4'-METHYLENEBIS(2-((4-AMINOPHENYL)METHYL)BENZENAMINE)4,4'-Methylenebis[2-[(4-aminophenyl)methyl]benzenamine]RefChem:198478DTXCID8044464
Show more names
265-389-365086-99-93,3'-Bis(p-aminobenzyl)-4,4'-diaminodiphenylmethane4,4'-methylenebis(2-(4-aminobenzyl)aniline)4,4'-methylenebis[2-(4-aminobenzyl)aniline]UNII-V4YYC47ZP6BCYHURLIXRJERG-UHFFFAOYSA-NNS00035791
Database identifiers
- CAS
65086-99-9- PubChem CID
- 103158
- DTXSID
DTXSID1070193- UNII
- V4YYC47ZP6
- EC Number
- 265-389-3
- Nikkaji
- J286.654D
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 477
Physicochemical properties
- Boiling point
- 670.6 · 670.6±50.0 °C(Predicted)
- Density
- 1.213 · 1.213±0.06 g/cm3(Predicted)
- pka
- 5.46 · 5.46±0.25(Predicted)
- FDA UNII
- 4 YYC47ZP6 · V4YYC47ZP6
- EPA Substance Registry System
- 4 · Benzenamine, 4,4'-methylenebis[2-[(4-aminophenyl)methyl]- (65086-99-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenamine, 4,4'-methylenebis[2-[(4-aminophenyl)methyl]-: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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