(1E)-Oxo(4-pyridinyl)ethanal oxime
Basic information
- CAS
90036-10-5- Standard SMILES
O=C(/C=N/O)c1ccncc1- InChIKey
AJMZEKZSNIRQIF-WEVVVXLNSA-N- Molecular formula
- C7H6N2O2
- Average molar mass
- 150.13 g/mol
- Monoisotopic mass
- 150.04292744
Names & identifiers
- Preferred name
- (1E)-Oxo(4-pyridinyl)ethanal oxime
- IUPAC
- (2E)-2-hydroxyimino-1-pyridin-4-ylethanone
Names & synonyms
NSC87277SCHEMBL4828445DTXSID90423244AJMZEKZSNIRQIF-WEVVVXLNSA-N90036-10-5(1E)-Oxo(4-pyridinyl)ethanal oxime #(2E)-2-(Hydroxyimino)-1-(pyridin-4-yl)ethan-1-one
Database identifiers
- CAS
90036-10-5- PubChem CID
- 9602541
- DTXSID
DTXSID90423244
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 162
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Compound notes
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