Basic information
- CAS
78865-83-5- Standard SMILES
CCCCCCCCCCSCn1cc[n+](C)c1.[Cl-]- InChIKey
VMMIAWVAQJZGDW-UHFFFAOYSA-M- Molecular formula
- C15H29ClN2S
- Average molar mass
- 304.9 g/mol
- Monoisotopic mass
- 304.1739978
Names & identifiers
- Preferred name
- 1-((Decylthio)methyl)-3-methyl-1H-imidazolium chloride
- IUPAC
- 1-(decylsulfanylmethyl)-3-methylimidazol-3-ium chloride
Names & synonyms
IPO 458078865-83-5CCRIS 2704N-Methyl-N'-decylthiomethylimidazolyl chloride1-((Decylthio)methyl)-3-methyl-1H-imidazolium chloride1H-IMIDAZOLIUM, 1-((DECYLTHIO)METHYL)-3-METHYL-, CHLORIDEDTXSID5010000901-[(Decylsulfanyl)methyl]-3-methyl-1H-imidazol-3-ium chloride
Database identifiers
- CAS
78865-83-5- PubChem CID
- 54293
- DTXSID
DTXSID501000090
Properties
Computed structural properties
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 187
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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