(2Z)-[(4E)-4-(Hydroxyimino)naphthalen-1(4H)-ylidene](phenyl)acetonitrile
Basic information
- CAS
737-43-9- Standard SMILES
N#C/C(=C1C=C/C(=N\O)c2ccccc2/1)c1ccccc1- InChIKey
SIQPMYJADMQLNS-AYEGBKGMSA-N- Molecular formula
- C18H12N2O
- Average molar mass
- 272.3 g/mol
- Monoisotopic mass
- 272.09496301
Names & identifiers
- Preferred name
- (2Z)-[(4E)-4-(Hydroxyimino)naphthalen-1(4H)-ylidene](phenyl)acetonitrile
- IUPAC
- (2Z)-2-[(4E)-4-hydroxyiminonaphthalen-1-ylidene]-2-phenylacetonitrile
Names & synonyms
737-43-9DTXSID70424830(2Z)-[(4E)-4-(Hydroxyimino)naphthalen-1(4H)-ylidene](phenyl)acetonitrile
Database identifiers
- CAS
737-43-9- PubChem CID
- 6300461
- DTXSID
DTXSID70424830
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 56.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 529
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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