Basic information
- CAS
816-75-1- Standard SMILES
CN(C)C(=S)SCC(N)=O- InChIKey
YVDBHZMPCSXUHG-UHFFFAOYSA-N- Molecular formula
- C5H10N2OS2
- Average molar mass
- 178.3 g/mol
- Monoisotopic mass
- 178.02345529
Names & identifiers
- Preferred name
- (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate
- IUPAC
- (2-amino-2-oxoethyl) N,N-dimethylcarbamodithioate
Names & synonyms
816-75-1NSC407820NSC 407820CHEMBL2005611DTXSID10324840NSC-407820NCI60_0038992-Amino-2-oxoethyl dimethylcarbamodithioateCarbamodithioic acid, N,N-dimethyl-, 2-amino-2-oxoethyl ester
Database identifiers
- CAS
816-75-1- PubChem CID
- 348488
- DTXSID
DTXSID10324840- ChEMBL
CHEMBL2005611
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 147
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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