Methyl 3-(4-methoxyphenyl)-1,1-dioxo-1lambda~6~,2-thiazetidine-2-carboxylate
Basic information
- CAS
36743-48-3- Standard SMILES
COC(=O)N1C(c2ccc(OC)cc2)CS1(=O)=O- InChIKey
OAEDOYLOMBZVEK-UHFFFAOYSA-N- Molecular formula
- C11H13NO5S
- Average molar mass
- 271.29 g/mol
- Monoisotopic mass
- 271.05144369
Names & identifiers
- Preferred name
- Methyl 3-(4-methoxyphenyl)-1,1-dioxo-1lambda~6~,2-thiazetidine-2-carboxylate
- IUPAC
- methyl 3-(4-methoxyphenyl)-1,1-dioxothiazetidine-2-carboxylate
Names & synonyms
36743-48-3NSC174529DTXSID80306173NSC-174529Methyl 3-(4-methoxyphenyl)-1,1-dioxo-1lambda~6~,2-thiazetidine-2-carboxylate
Database identifiers
- CAS
36743-48-3- PubChem CID
- 300201
- DTXSID
DTXSID80306173
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 81.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 408
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Compound notes
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