Basic information
- CAS
56065-47-5- Standard SMILES
CCCC([NH3+])(CC)CC.[Cl-]- InChIKey
MHJOKATYCDQHDI-UHFFFAOYSA-N- Molecular formula
- C8H20ClN
- Average molar mass
- 165.7 g/mol
- Monoisotopic mass
- 165.1284273
Names & identifiers
- Preferred name
- 3-Hexanamine, 3-ethyl-, hydrochloride (1:1)
- IUPAC
- 3-ethylhexan-3-ylazanium chloride
Names & synonyms
56065-47-5RefChem:10678963-Hexanamine, 3-ethyl-, hydrochloride (1:1)3-Ethyl-3-hexanamine hydrochlorideLCG 215733-HEXANAMINE, 3-ETHYL-, HYDROCHLORIDE
Database identifiers
- CAS
56065-47-5- PubChem CID
- 41706
Properties
Computed structural properties
- Topological polar surface area
- 27.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 65
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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