Basic information
- CAS
59375-67-6- Standard SMILES
CNC(=O)ON=C1CSC(C)(C)S1- InChIKey
VYOXJEOCICEUOX-UHFFFAOYSA-N- Molecular formula
- C7H12N2O2S2
- Average molar mass
- 220.3 g/mol
- Monoisotopic mass
- 220.03401998
Names & identifiers
- Preferred name
- [(2,2-dimethyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate
- IUPAC
- [(2,2-dimethyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate
Names & synonyms
DTXSID001032018[(2,2-dimethyl-1,3-dithiolan-4-ylidene)amino] N-methylcarbamate
Database identifiers
- CAS
59375-67-6- PubChem CID
- 43014
- DTXSID
DTXSID001032018
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 241
Experimental & physicochemical properties
LogP1.33
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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