Basic information
- CAS
66195-26-4- Standard SMILES
CC(C)CCC(C)Nc1ccc(N=O)cc1- InChIKey
NRGBRLBYBMBIAR-UHFFFAOYSA-N- Molecular formula
- C13H20N2O
- Average molar mass
- 220.31 g/mol
- Monoisotopic mass
- 220.15756327
Names & identifiers
- Preferred name
- Benzenamine, N-(1,4-dimethylpentyl)-4-nitroso-
- IUPAC
- N-(5-methylhexan-2-yl)-4-nitrosoaniline
- English name
- N-(1,4-Dimethylpentyl)-4-nitrosoaniline
- Molecular formula
- C13H20N2O
- Molecular weight
- 220.31
Names & synonyms
Benzenamine, N-(1,4-dimethylpentyl)-4-nitroso-N-(1,4-Dimethylpentyl)-4-nitrosoaniline66195-26-4DTXSID90886572RefChem:561958DTXCID301025896N-(5-methylhexan-2-yl)-4-nitrosoanilineSCHEMBL638296NRGBRLBYBMBIAR-UHFFFAOYSA-N
Database identifiers
- CAS
66195-26-4- PubChem CID
- 3017652
- DTXSID
DTXSID90886572
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 198
Physicochemical properties
- EPA Substance Registry System
- Benzenamine, N-(1,4-dimethylpentyl)-4-nitroso- (66195-26-4)
- 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.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenamine, N-(1,4-dimethylpentyl)-4-nitroso-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…