Colesevelam Impurity 4
Basic information
- CAS
676578-21-5- Standard SMILES
C[N+](C)(C)CCCCCCO.[Cl-]- InChIKey
DZKPGUWRLXLWOD-UHFFFAOYSA-M- Molecular formula
- C9H22ClNO
- Average molar mass
- 195.73 g/mol
- Monoisotopic mass
- 195.138992
Names & identifiers
- Preferred name
- Colesevelam Impurity 4
- IUPAC
- 6-hydroxyhexyl(trimethyl)azanium chloride
- English name
- Colesavelam Hydroxyquat Impurity
- Molecular formula
- C9H22ClNO
- Molecular weight
- 195.73
Names & synonyms
Colesevelam Impurity 4Colesevelam Hydroxyquat Impurity Chloride6-hydroxy-N,N,N-trimethylhexan-1-aminium chlorideSCHEMBL3513770Colesevelam ImpurityColesevelam Hydroxyquat ChlorideColesavelam Hydroxyquat ImpurityColesevelamHydroxyquatImpurityChloride6-Hydroxyhexyl Trimethylammonium Chloride
Database identifiers
- CAS
676578-21-5- PubChem CID
- 13115277
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 86.1
Chemistry & industry
Applications
Uses6-Hydroxyhexyl Trimethylammonium Chloride is an impurity of Colesevelam (C640000), which may be used to help reduce elevated low-density lipoprotein (LDL) cholesterol in patients with primary hyperlipidemia as well as to improve glycemic control in patients with type 2 diabetes. Also used as a reagent in peptide synthesis.
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Compound notes
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