Basic information
- CAS
7134-82-9- Standard SMILES
O=c1oc2ccccc2c(=S)n1-c1ccccc1- InChIKey
LSBVQBIIKZGFLM-UHFFFAOYSA-N- Molecular formula
- C14H9NO2S
- Average molar mass
- 255.29 g/mol
- Monoisotopic mass
- 255.0353997
Names & identifiers
- Preferred name
- 3-Phenyl-4-sulfanylidene-3,4-dihydro-2H-1,3-benzoxazin-2-one
- IUPAC
- 3-phenyl-4-sulfanylidene-1,3-benzoxazin-2-one
Names & synonyms
7134-82-9DTXSID503104293-Phenyl-4-sulfanylidene-3,4-dihydro-2H-1,3-benzoxazin-2-oneRefChem:281755DTXCID20261555NSC227154NSC-2271543-phenyl-4-thioxo-2h-1,3-benzoxazine-2(3h)-one
Database identifiers
- CAS
7134-82-9- PubChem CID
- 313316
- DTXSID
DTXSID50310429
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 61.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 352
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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