Basic information
- CAS
57270-51-6- Standard SMILES
CSC(CN)SC- InChIKey
IHJVGXNOQWLWOF-UHFFFAOYSA-N- Molecular formula
- C4H11NS2
- Average molar mass
- 137.3 g/mol
- Monoisotopic mass
- 137.0332917
Names & identifiers
- Preferred name
- 2,2-Bis(methylsulfanyl)ethan-1-amine
- IUPAC
- 2,2-bis(methylsulfanyl)ethanamine
Names & synonyms
2,2-Bis(methylsulfanyl)ethan-1-amine57270-51-6DTXSID40494909RefChem:243058DTXCID404457192,2-dimethylthioethylamineAKOS006360883
Database identifiers
- CAS
57270-51-6- PubChem CID
- 12372266
- DTXSID
DTXSID40494909
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 76.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 36.7
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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