Pyridinium, 1-hexadecyl-2-methyl-, bromide (1:1)
Basic information
- CAS
20667-13-4- Standard SMILES
CCCCCCCCCCCCCCCC[n+]1ccccc1C.[Br-]- InChIKey
JRCWHWCFGYZDST-UHFFFAOYSA-M- Molecular formula
- C22H40BrN
- Average molar mass
- 398.5 g/mol
- Monoisotopic mass
- 397.23441
Names & identifiers
- Preferred name
- Pyridinium, 1-hexadecyl-2-methyl-, bromide (1:1)
- IUPAC
- 1-hexadecyl-2-methylpyridin-1-ium bromide
- English name
- 1-hexadecyl-6-methyl-pyridine bromide
- Molecular formula
- C22H40BrN
- Molecular weight
- 398.46
Names & synonyms
20667-13-4Pyridinium, 1-hexadecyl-2-methyl-, bromideCetyl-alpha-picolinium bromidePyridinium, 1-hexadecyl-2-methyl-, bromide (1:1)DTXSID30885145RefChem:177654DTXCID3010245431-hexadecyl-2-methylpyridin-1-ium bromideSCHEMBL636963JRCWHWCFGYZDST-UHFFFAOYSA-M1-HEXADECYL-6-METHYL-PYRIDINE BROMIDEH81397
Show more names
1-Hexadecyl-2-methylpyridinium bromide
Database identifiers
- CAS
20667-13-4- PubChem CID
- 88642
- DTXSID
DTXSID30885145
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
- 82 · 82-84 °C(Solvent: Ethyl acetate; Dichloromethane (4:1))
- EPA Substance Registry System
- 1 · Pyridinium, 1-hexadecyl-2-methyl-, bromide (20667-13-4)
- 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-, bromide (1:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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