Basic information
- CAS
3489-45-0- Standard SMILES
CC1CSC(=S)S1- InChIKey
OVMVMMNHNMZUAS-UHFFFAOYSA-N- Molecular formula
- C4H6S3
- Average molar mass
- 150.3 g/mol
- Monoisotopic mass
- 149.96316371
Names & identifiers
- Preferred name
- 4-Methyl-1,3-dithiolane-2-thione
- IUPAC
- 4-methyl-1,3-dithiolane-2-thione
Names & synonyms
NSC-404493489-45-04-methyl-1,3-dithiolane-2-thione1, 4-methylcyclic trithiocarbonate-1,2-Propanedithiolpropylene tri-thiocarbonateZ2NZZ67DKW1,- cyclic carbonotrithioateSCHEMBL1378256NSC404491,3-Dithiolane-2-thione, 4-methyl-Carbonic acid, trithio-, propylene ester
Show more names
1,2-Propanedithiol, cyclic carbonotrithioateCarbonic acid, trithio-, cyclic propylene ester
Database identifiers
- CAS
3489-45-0- PubChem CID
- 237161
- UNII
- Z2NZZ67DKW
- Nikkaji
- J706.476D
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 82.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 88.9
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…