sec-Butylammonium chloride
Basic information
- CAS
10049-60-2- Standard SMILES
CCC(C)[NH3+].[Cl-]- InChIKey
VBPUICBFVUTJSE-UHFFFAOYSA-N- Molecular formula
- C4H12ClN
- Average molar mass
- 109.6 g/mol
- Monoisotopic mass
- 109.0658271
Overview
See also: 2-Butanamine, hydrochloride (preferred); Sec-Butylamine (annotation moved to).
Names & identifiers
- Preferred name
- sec-Butylammonium chloride
- IUPAC
- butan-2-ylazanium chloride
- English name
- sec-butylammonium chloride
- Molecular formula
- C4H12ClN
- Molecular weight
- 109.59778
Names & synonyms
sec-Butylammonium chloridebutan-2-ylazanium;chloridesec-BUTYLAMINE, HYDROCHLORIDE2-Butylamine hydrochloride2-Aminobutane hydrochlorideEINECS 233-176-4ethyl-ethanaminium chlorideNS00082854D86790butan-2-amine hydrochloridesec-butylamine hydrochloride2-Butanamine,hydrochloride (9CI)
Database identifiers
- CAS
10049-60-2- PubChem CID
- 24873
- EC Number
- 233-176-4
Properties
Computed structural properties
- Topological polar surface area
- 27.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 19.6
Physicochemical properties
- Melting point
- 152 · 152-153 °C
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Compound notes
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