2,2-dichloro-N-[1-hydroxy-3-(methylsulfanylmethylsulfanyl)propan-2-yl]acetamide
Basic information
- CAS
5199-56-4- Standard SMILES
CSCSCC(CO)NC(=O)C(Cl)Cl- InChIKey
RWOBECWSTZIOMF-UHFFFAOYSA-N- Molecular formula
- C7H13Cl2NO2S2
- Average molar mass
- 278.2 g/mol
- Monoisotopic mass
- 276.9764764
Names & identifiers
- Preferred name
- 2,2-dichloro-N-[1-hydroxy-3-(methylsulfanylmethylsulfanyl)propan-2-yl]acetamide
- IUPAC
- 2,2-dichloro-N-[1-hydroxy-3-(methylsulfanylmethylsulfanyl)propan-2-yl]acetamide
Names & synonyms
5199-56-4NSC2272962,2-dichloro-N-[1-hydroxy-3-(methylsulfanylmethylsulfanyl)propan-2-yl]acetamideDTXSID00310454NSC-2272962,2-Dichloro-N-(1-hydroxy-3-{[(methylsulfanyl)methyl]sulfanyl}propan-2-yl)acetamide
Database identifiers
- CAS
5199-56-4- PubChem CID
- 313383
- DTXSID
DTXSID00310454
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 99.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 172
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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