methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate
Basic information
- CAS
75089-07-5- Standard SMILES
CSC(C)=NOC(=O)N(C)CO- InChIKey
LRYXRVLBGBJMCM-UHFFFAOYSA-N- Molecular formula
- C6H12N2O3S
- Average molar mass
- 192.24 g/mol
- Monoisotopic mass
- 192.05686342
Names & identifiers
- Preferred name
- methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate
- IUPAC
- methyl N-[hydroxymethyl(methyl)carbamoyl]oxyethanimidothioate
Names & synonyms
75089-07-5Ethanimidothioic acid, N-[[[(hydroxymethyl)methylamino]carbonyl]oxy]-, methyl ester
Database identifiers
- CAS
75089-07-5- PubChem CID
- 93448
- DTXSID
DTXSID8073633
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 87.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 184
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Compound notes
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