Basic information
- CAS
106130-13-6- Standard SMILES
CCCCCCCCCC[N+](C)(C)CC(O)CCl.[Cl-]- InChIKey
UVNFMNQJFRLKST-UHFFFAOYSA-M- Molecular formula
- C15H33Cl2NO
- Average molar mass
- 314.3 g/mol
- Monoisotopic mass
- 313.1939201
Names & identifiers
- Preferred name
- (3-Chloro-2-hydroxypropyl)-decyl-dimethylazanium chloride
- IUPAC
- (3-chloro-2-hydroxypropyl)-decyl-dimethylazanium chloride
Names & synonyms
K9U1ZW5HLQ106130-13-6UNII-K9U1ZW5HLQ(3-Chloro-2-hydroxypropyl)-decyl-dimethylazanium chloride1-Decanaminium, N-(3-chloro-2-hydroxypropyl)-N,N-dimethyl-, chloride (1:1)SCHEMBL3020141DTXSID70611243N-(3-Chloro-2-hydroxypropyl)-N,N-dimethyldecan-1-aminium chloride
Database identifiers
- CAS
106130-13-6- PubChem CID
- 21189257
- DTXSID
DTXSID70611243- UNII
- K9U1ZW5HLQ
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 12
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 185
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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