Glyoxal, p-nitrophenyl-, dimethyl hydrazone
Basic information
- CAS
25555-13-9- Standard SMILES
CN(C)/N=C/C(=O)c1ccc([N+](=O)[O-])cc1- InChIKey
XCXOXKAHWNKLJY-YRNVUSSQSA-N- Molecular formula
- C10H11N3O3
- Average molar mass
- 221.21 g/mol
- Monoisotopic mass
- 221.08004122
Names & identifiers
- Preferred name
- Glyoxal, p-nitrophenyl-, dimethyl hydrazone
- IUPAC
- (2E)-2-(dimethylhydrazinylidene)-1-(4-nitrophenyl)ethanone
- English name
- p-Nitro-α-(dimethylhydrazono)acetophenone
- Molecular formula
- C10H11N3O3
- Molecular weight
- 221.22
Names & synonyms
GLYOXAL, p-NITROPHENYL-, DIMETHYL HYDRAZONE25555-13-9RefChem:1086116p-Nitrophenylglyoxal N,N-dimethylhydrazoneBRN 24583394-Nitrophenylglyoxal N,N-dimethylhydrazonep-Nitro-α-(dimethylhydrazono)acetophenoneBenzeneacetaldehyde, 4-nitro-α-oxo-, aldehydo-(2,2-dimethylhydrazone)
Database identifiers
- CAS
25555-13-9- PubChem CID
- 9570403
- Nikkaji
- J49.239F
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 288
Physicochemical properties
- Melting point
- 139 · 139-141 °C
- Boiling point
- 370.7 · 370.7±44.0 °C(Predicted)
- Density
- 1.21 · 1.21±0.1 g/cm3(Predicted)
- pka
- -2.85 · -2.85±0.70(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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