Basic information
- CAS
99244-46-9- Standard SMILES
CCCCCCCCC=CCCCCCCCC[N+](C)(CCO)CCO.[Cl-]- InChIKey
RBRXPPLNXDVMKG-UHFFFAOYSA-M- Molecular formula
- C23H48ClNO2
- Average molar mass
- 406.1 g/mol
- Monoisotopic mass
- 405.3373575
Names & identifiers
- Preferred name
- Bis(2-hydroxyethyl)-methyl-octadec-9-enylazanium chloride
- IUPAC
- bis(2-hydroxyethyl)-methyl-octadec-9-enylazanium chloride
Names & synonyms
99244-46-9SCHEMBL314036DTXSID00275852NS00013942N,N-Bis(2-hydroxyethyl)-N-methyloctadec-9-en-1-aminium chloride
Database identifiers
- CAS
99244-46-9- PubChem CID
- 87648
- DTXSID
DTXSID00275852- EC Number
- 619-412-2
Properties
Computed structural properties
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 20
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 299
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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