Basic information
- CAS
66753-00-2- Standard SMILES
CC[N+](C)(CC)CCS.[I-]- InChIKey
KTQKLDQLZYBMHS-UHFFFAOYSA-N- Molecular formula
- C7H18INS
- Average molar mass
- 275.2 g/mol
- Monoisotopic mass
- 275.02047
Names & identifiers
- Preferred name
- Ammonium, diethyl(2-mercaptoethyl)methyl-, iodide
- IUPAC
- diethyl-methyl-(2-sulfanylethyl)azanium iodide
Names & synonyms
2-Methyldiethylammoniumethylthiole iodideDiethyl(2-mercaptoethyl)methylammonium iodideEthanaminium, N,N-diethyl-2-mercapto-N-methyl-, iodideAMMONIUM, DIETHYL(2-MERCAPTOETHYL)METHYL-, IODIDE66753-00-2RefChem:319242
Database identifiers
- CAS
66753-00-2- PubChem CID
- 48028
Properties
Computed structural properties
- Topological polar surface area
- 1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 69.3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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