Basic information
- CAS
190852-41-6- Standard SMILES
CS(=O)(=O)SCCN- InChIKey
POKQFZURBRODMI-UHFFFAOYSA-N- Molecular formula
- C3H9NO2S2
- Average molar mass
- 155.2 g/mol
- Monoisotopic mass
- 155.00747088
Names & identifiers
- Preferred name
- 2-Methylsulfonylsulfanylethanamine
- IUPAC
- 2-methylsulfonylsulfanylethanamine
Names & synonyms
190852-41-62-(methanesulfonylsulfanyl)ethan-1-amineS-(2-Aminoethyl) methanesulfonothioateCHEMBL2567382-Methylsulfonylsulfanylethylazanium bromide2-methylsulfonylsulfanylethanamineSCHEMBL368519DTXSID00328695(2-aminoethyl)methanethiosulphonateS-2-Aminoethyl MethanesulfonothioateBDBM50203071HSCI1_000031
Show more names
EN300-366604
Database identifiers
- CAS
190852-41-6- PubChem CID
- 413295
- DTXSID
DTXSID00328695- ChEMBL
CHEMBL256738- Nikkaji
- J793.734B
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 93.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 134
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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