Basic information
- CAS
61792-45-8- Standard SMILES
CCCCC(C)N(c1ccccc1)c1ccc(N)cc1- InChIKey
GTVCEXILOPOQQF-UHFFFAOYSA-N- Molecular formula
- C18H24N2
- Average molar mass
- 268.4 g/mol
- Monoisotopic mass
- 268.19394877
Names & identifiers
- Preferred name
- 1,4-Benzenediamine, N1-(1-methylpentyl)-N1-phenyl-
- IUPAC
- 4-N-hexan-2-yl-4-N-phenylbenzene-1,4-diamine
- English name
- N-(1-Methylpentyl)-N-phenyl-1,4-benzenediamine
- Molecular formula
- C18H24N2
- Molecular weight
- 268.4
Names & synonyms
61792-45-81,4-Benzenediamine, N-(1-methylpentyl)-N-phenyl-1,4-Benzenediamine, N1-(1-methylpentyl)-N1-phenyl-DTXSID60886463RefChem:415910DTXCID901025787SCHEMBL5340432GTVCEXILOPOQQF-UHFFFAOYSA-NN~1~-(Hexan-2-yl)-N~1~-phenylbenzene-1,4-diamineN-(1-Methylpentyl)-N-phenyl-1,4-benzenediamine
Database identifiers
- CAS
61792-45-8- PubChem CID
- 112449
- DTXSID
DTXSID60886463- Nikkaji
- J429.434C
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 252
Physicochemical properties
- EPA Substance Registry System
- 1 · 1,4-Benzenediamine, N-(1-methylpentyl)-N-phenyl- (61792-45-8)
- 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 Information1,4-Benzenediamine, N1-(1-methylpentyl)-N1-phenyl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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