N-[4-(hydroxyiminomethyl)phenyl]acetamide
Basic information
- CAS
5351-33-7- Standard SMILES
CC(=O)Nc1ccc(C=NO)cc1- InChIKey
SZGJLXKFWSTIKP-UHFFFAOYSA-N- Molecular formula
- C9H10N2O2
- Average molar mass
- 178.19 g/mol
- Monoisotopic mass
- 178.07422757
Names & identifiers
- Preferred name
- N-[4-(hydroxyiminomethyl)phenyl]acetamide
- IUPAC
- N-[4-(hydroxyiminomethyl)phenyl]acetamide
- English name
- Acetamide, N-[4-[(hydroxyimino)methyl]phenyl]-
- Molecular formula
- C9H10N2O2
- Molecular weight
- 178.19
Names & synonyms
N-[4-(hydroxyiminomethyl)phenyl]acetamideSCHEMBL7871342DTXSID20277075AKOS017263580DS-002307(E)-N-(4-((Hydroxyimino)methyl)phenyl)acetamideAcetamide, N-[4-[(hydroxyimino)methyl]phenyl]-
Database identifiers
- CAS
5351-33-7- PubChem CID
- 219403
- DTXSID
DTXSID20277075
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 196
Physicochemical properties
- Melting point
- 210 °C · 210 °C
- Boiling point
- 386.183 · 386.183±25.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.172 · 1.172±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.716 · 10.716±0.10(predicted)
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Compound notes
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