Basic information
- Standard SMILES
ON=C1CCCc2cnc(Cl)nc21- InChIKey
BHVYHRITSDFTPA-UHFFFAOYSA-N- Molecular formula
- C8H8ClN3O
- Average molar mass
- 197.62 g/mol
- Monoisotopic mass
- 197.0355896
Names & identifiers
- Preferred name
- 2-Chloro-6,7-dihydro-5H-quinazolin-8-one oxime
- IUPAC
- N-(2-chloro-6,7-dihydro-5H-quinazolin-8-ylidene)hydroxylamine
Names & synonyms
SCHEMBL428294SCHEMBL30777929BHVYHRITSDFTPA-UHFFFAOYSA-N2-Chloro-6,7-dihydro-5H-quinazolin-8-one oxime
Database identifiers
- PubChem CID
- 136342880
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 221
Related reactions
4 records
Compound notes
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