Basic information
- CAS
734506-82-2- Standard SMILES
CCCCCCCCCCOC(=O)c1cc[n+](C)cc1- InChIKey
SYWHJGMPHRACDW-UHFFFAOYSA-N- Molecular formula
- C17H28NO2+
- Average molar mass
- 278.4 g/mol
- Monoisotopic mass
- 278.21200414
Names & identifiers
- Preferred name
- Pyridinium, 4-[(decyloxy)carbonyl]-1-methyl-
- IUPAC
- decyl 1-methylpyridin-1-ium-4-carboxylate
Names & synonyms
NSC625460Pyridinium, 4-[(decyloxy)carbonyl]-1-methyl-decyl 1-methylpyridin-1-ium-4-carboxylate4-[(decyloxy)carbonyl]-1-methylpyridin-1-iumCHEMBL2010543DTXSID501270388734506-82-2NCI60_0078624-[(Decyloxy)carbonyl]-1-methylpyridinium
Database identifiers
- CAS
734506-82-2- PubChem CID
- 361981
- DTXSID
DTXSID501270388- ChEMBL
CHEMBL2010543- Nikkaji
- J426.894F
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 20
- Formal charge
- 1
- Complexity
- 247
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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