Basic information
- Standard SMILES
O=C(OCC1COC(=S)N1)c1ccccc1- InChIKey
PTWCTVOLTDOAJR-UHFFFAOYSA-N- Molecular formula
- C11H11NO3S
- Average molar mass
- 237.28 g/mol
- Monoisotopic mass
- 237.04596439
Names & identifiers
- Preferred name
- Benzoic acid 2-thioxo-oxazolidin-4-ylmethyl ester
- IUPAC
- (2-sulfanylidene-1,3-oxazolidin-4-yl)methyl benzoate
Names & synonyms
PTWCTVOLTDOAJR-UHFFFAOYSA-Nbenzoic acid 2-thioxo-oxazolidin-4-ylmethyl ester
Database identifiers
- PubChem CID
- 86601550
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 79.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 276
Related reactions
1 records
Compound notes
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