Basic information
- Standard SMILES
COc1cc(Cl)cc2c(=O)oc(=O)[nH]c12- InChIKey
GASSUVYMTURYOF-UHFFFAOYSA-N- Molecular formula
- C9H6ClNO4
- Average molar mass
- 227.6 g/mol
- Monoisotopic mass
- 226.9985354
Names & identifiers
- Preferred name
- 6-chloro-8-methoxy-1H-benzo[d][1,3]oxazine-2,4-dione
- IUPAC
- 6-chloro-8-methoxy-1H-3,1-benzoxazine-2,4-dione
Names & synonyms
SCHEMBL1515083GASSUVYMTURYOF-UHFFFAOYSA-N6-chloro-8-methoxy-1H-benzo[d][1,3]oxazine-2,4-dione
Database identifiers
- PubChem CID
- 86670580
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 296
Related reactions
1 records
Compound notes
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