Basic information
- CAS
37204-63-0- Standard SMILES
O=C1Cc2ccccc2ON1- InChIKey
HQQTZCPKNZVLFF-UHFFFAOYSA-N- Molecular formula
- C8H7NO2
- Average molar mass
- 149.15 g/mol
- Monoisotopic mass
- 149.04767846
Names & identifiers
- Preferred name
- 2H-1,2-Benzoxazin-3(4H)-one
- IUPAC
- 4H-1,2-benzoxazin-3-one
Names & synonyms
DTXSID306014282H-1,2-Benzoxazin-3(4H)-one37204-63-0RefChem:267676DTXCID50552185SCHEMBL69374H-1,2-benzoxazin-3-oneSCHEMBL181162SCHEMBL965211SCHEMBL1116430SCHEMBL1450833SCHEMBL1452118
Show more names
SCHEMBL1491183SCHEMBL2075820SCHEMBL19691108SCHEMBL29408741
Database identifiers
- CAS
37204-63-0- PubChem CID
- 19937448
- DTXSID
DTXSID30601428
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 169
Related reactions
25 records
Compound notes
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