2-Heptanamine, N-methyl-, hydrochloride (1:1)
Basic information
- CAS
5787-73-5- Standard SMILES
CCCCCC(C)[NH2+]C.[Cl-]- InChIKey
JNCLSNBVQMUCGR-UHFFFAOYSA-N- Molecular formula
- C8H20ClN
- Average molar mass
- 165.7 g/mol
- Monoisotopic mass
- 165.1284273
Names & identifiers
- Preferred name
- 2-Heptanamine, N-methyl-, hydrochloride (1:1)
- IUPAC
- heptan-2-yl(methyl)azanium chloride
Names & synonyms
5787-73-5RefChem:10632642-Heptanamine, N-methyl-, hydrochloride (1:1)2-Methylamino-heptane, hydrochlorideEA-1 hydrochlorideOenethyl hydrochloridePacamine hydrochlorideNeosupranol hydrochlorideN,1-Dimethylhexylamine hydrochlorideHEXYLAMINE, N,1-DIMETHYL-, HYDROCHLORIDE
Database identifiers
- CAS
5787-73-5- PubChem CID
- 22029
Properties
Computed structural properties
- Topological polar surface area
- 16.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 52.5
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Compound notes
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