Basic information
- CAS
114811-36-8- Standard SMILES
C=CSCCSCCCl- InChIKey
CBVAXGNCAZECCK-UHFFFAOYSA-N- Molecular formula
- C6H11ClS2
- Average molar mass
- 182.7 g/mol
- Monoisotopic mass
- 181.9990704
Names & identifiers
- Preferred name
- 2-(2-Chloroethylthio)ethylthioethene
- IUPAC
- 1-(2-chloroethylsulfanyl)-2-ethenylsulfanylethane
Names & synonyms
114811-36-82-(2-Chloroethylthio)ethylthioethene(2-Chloroethylthio)ethyl vinyl sulfide({2-[(2-chloroethyl)sulfanyl]ethyl}sulfanyl)etheneDTXSID90150861CBVAXGNCAZECCK-UHFFFAOYSA-N
Database identifiers
- CAS
114811-36-8- PubChem CID
- 189243
- DTXSID
DTXSID90150861- Nikkaji
- J522.330J
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 66.1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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