Basic information
- CAS
30411-35-9- Standard SMILES
CCS/C(C)=N\OC(=O)N(C)C(C)=O- InChIKey
GQRQHDUZRILIGF-TWGQIWQCSA-N- Molecular formula
- C8H14N2O3S
- Average molar mass
- 218.28 g/mol
- Monoisotopic mass
- 218.07251349
Names & identifiers
- Preferred name
- Acetimidic acid, N-((acetylmethylcarbamoyl)oxy)thio-, ethyl ester
- IUPAC
- ethyl (1Z)-N-[acetyl(methyl)carbamoyl]oxyethanimidothioate
Names & synonyms
ACETIMIDIC ACID, N-((ACETYLMETHYLCARBAMOYL)OXY)THIO-, ETHYL ESTER30411-35-9RefChem:1075865N-((Acetylmethylcarbamoyl)oxy)thioacetimidic acid ethyl esterBRN 2096034
Database identifiers
- CAS
30411-35-9- PubChem CID
- 6514865
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 84.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 253
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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