Basic information
- CAS
886497-86-5- Standard SMILES
CCOC(=O)c1sc(=O)[nH]c1-c1ccc(OC)c(OC)c1- InChIKey
UXMXGLYGUCLHIU-UHFFFAOYSA-N- Molecular formula
- C14H15NO5S
- Average molar mass
- 309.34 g/mol
- Monoisotopic mass
- 309.06709375
Names & identifiers
- Preferred name
- 4-(3,4-Dimethoxy-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester
- IUPAC
- ethyl 4-(3,4-dimethoxyphenyl)-2-oxo-3H-1,3-thiazole-5-carboxylate
- English name
- 4-(3,4-Dimethoxy-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl ester
- Molecular formula
- C14H15NO5S
- Molecular weight
- 309.34
Names & synonyms
886497-86-54-(3,4-Dimethoxy-phenyl)-2-oxo-2,3-dihydro-thiazole-5-carboxylic acid ethyl esterEthyl 4-(3,4-dimethoxyphenyl)-2-oxo-2,3-dihydrothiazole-5-carboxylateethyl 4-(3,4-dimethoxyphenyl)-2-oxo-3H-1,3-thiazole-5-carboxylate2,3-dihydro-4-(3,4-dimethoxyphenyl)-2-oxo-5-thiazolecarboxylic acid ethyl esterDTXSID201157284F026962ethyl 4-(3,4-dimethoxyphenyl)-2-oxo-3H-thiazole-5-carboxylateEthyl 4-(3,4-dimethoxyphenyl)-2,3-dihydro-2-oxo-5-thiazolecarboxylateEthyl4-(3,4-dimethoxyphenyl)-2-oxo-2,3-dihydrothiazole-5-carboxylateEthyl 4-(3,4-dimethoxyphenyl)-2-oxo-2,3-dihydro-1,3-thiazole-5-carboxylate5-Thiazolecarboxylic acid, 4-(3,4-dimethoxyphenyl)-2,3-dihydro-2-oxo-, ethyl ester
Database identifiers
- CAS
886497-86-5- PubChem CID
- 7174180
- DTXSID
DTXSID201157284
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 99.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 451
Chemistry & industry
Suppliers4 total
Fluorochem Ltd[email protected]
FLRO-SR[email protected]
OAKWOOD[email protected]
CHEMCOLLECT[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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