Pyridinium, 1-hexadecyl-2-methyl-, chloride (1:1)
Basic information
- CAS
14402-21-2- Standard SMILES
CCCCCCCCCCCCCCCC[n+]1ccccc1C.[Cl-]- InChIKey
TZRXOSWQYJSUIK-UHFFFAOYSA-M- Molecular formula
- C22H40ClN
- Average molar mass
- 354 g/mol
- Monoisotopic mass
- 353.284928
Names & identifiers
- Preferred name
- Pyridinium, 1-hexadecyl-2-methyl-, chloride (1:1)
- IUPAC
- 1-hexadecyl-2-methylpyridin-1-ium chloride
- English name
- Pyridinium,1-hexadecyl-2-methyl-,chloride
- Molecular formula
- C22H40ClN
- Molecular weight
- 354.0127
Names & synonyms
Cetyl-alpha-picolinium chloride14402-21-2Pyridinium, 1-hexadecyl-2-methyl-, chloride (1:1)RefChem:177655Pyridinium, 1-hexadecyl-2-methyl-, chloride1-hexadecyl-2-methylpyridin-1-ium chlorideSCHEMBL330337DTXSID50275802TZRXOSWQYJSUIK-UHFFFAOYSA-M1-Hexadecyl-2-methylpyridinium chloride (1:1)Pyridinium,1-hexadecyl-2-methyl-,chloride
Database identifiers
- CAS
14402-21-2- PubChem CID
- 84408
- DTXSID
DTXSID50275802
Properties
Computed structural properties
- Topological polar surface area
- 3.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 15
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 238
Physicochemical properties
- Melting point
- 101 · 101-130.5 °C
- EPA Substance Registry System
- 1 · Pyridinium, 1-hexadecyl-2-methyl-, chloride (14402-21-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPyridinium, 1-hexadecyl-2-methyl-, chloride (1:1): INACTIVE
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Related reactions
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Compound notes
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