Basic information
- CAS
55391-34-9- Standard SMILES
CNC(=O)ON=C1CSCCS1- InChIKey
KPINHOMFRQMSJA-UHFFFAOYSA-N- Molecular formula
- C6H10N2O2S2
- Average molar mass
- 206.3 g/mol
- Monoisotopic mass
- 206.01836991
Names & identifiers
- Preferred name
- (1,4-dithian-2-ylideneamino) N-methylcarbamate
- IUPAC
- (1,4-dithian-2-ylideneamino) N-methylcarbamate
Names & synonyms
DTXSID201031711(1,4-dithian-2-ylideneamino) N-methylcarbamate
Database identifiers
- CAS
55391-34-9- PubChem CID
- 41433
- DTXSID
DTXSID201031711
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 196
Experimental & physicochemical properties
LogP0.49
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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