O-methyl N-(4-ethoxyphenyl)carbamothioate
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Basic information
- CAS
91012-36-1- Standard SMILES
CCOc1ccc(NC(=S)OC)cc1- InChIKey
TVCVGPPNABIFJO-UHFFFAOYSA-N- Molecular formula
- C10H13NO2S
- Average molar mass
- 211.28 g/mol
Names & identifiers
- Preferred name
- O-methyl N-(4-ethoxyphenyl)carbamothioate
- IUPAC
- O-methyl N-(4-ethoxyphenyl)carbamothioate
- English name
- Carbanilic acid, p-ethoxythio-, O-methyl ester (6CI,7CI)
- Molecular formula
- C10H13NO2S
- Molecular weight
- 211.28072
Names & synonyms
Carbanilic acid, p-ethoxythio-, O-methyl ester (6CI,7CI)
Database identifiers
- CAS
91012-36-1
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 179
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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