Basic information
- CAS
2716-62-3- Standard SMILES
CCCC(C)Nc1ccccc1- InChIKey
HULIKQJHXKLBMI-UHFFFAOYSA-N- Molecular formula
- C11H17N
- Average molar mass
- 163.26 g/mol
- Monoisotopic mass
- 163.13609955
Names & identifiers
- Preferred name
- N-(pentan-2-yl)aniline
- IUPAC
- N-pentan-2-ylaniline
- English name
- Benzenamine, N-(1-methylbutyl)-
- Molecular formula
- C11H17N
- Molecular weight
- 163.25938
Names & synonyms
N-(pentan-2-yl)aniline2716-62-3DTXSID90334306RefChem:362818DTXCID60285396N-pentan-2-ylanilineN-Sec-amyl anilineN-(1-methylbutyl)aniline(-methylbutyl) anilineN-(1-methyl butyl)anilineSCHEMBL1454124SCHEMBL1454380
Show more names
Benzenamine, N-(1-methylbutyl)-
SCHEMBL1454381SCHEMBL4767457SCHEMBL9572685SCHEMBL9572748SCHEMBL10436617CAA71662AKOS000228224CS-0251411
Database identifiers
- CAS
2716-62-3- PubChem CID
- 520291
- DTXSID
DTXSID90334306- Nikkaji
- J539.690E
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 106
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers1 total
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
Related reactions
4 records
Compound notes
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