3-((p-Acetylphenyl)azo)-2,4-pentanedione
Basic information
- CAS
3937-14-2- Standard SMILES
CC(=O)c1ccc(N=NC(C(C)=O)C(C)=O)cc1- InChIKey
ATEFKWMTRLZTPR-UHFFFAOYSA-N- Molecular formula
- C13H14N2O3
- Average molar mass
- 246.26 g/mol
- Monoisotopic mass
- 246.10044231
Names & identifiers
- Preferred name
- 3-((p-Acetylphenyl)azo)-2,4-pentanedione
- IUPAC
- 3-[(4-acetylphenyl)diazenyl]pentane-2,4-dione
Names & synonyms
3-((p-Acetylphenyl)azo)-2,4-pentanedioneF 23164-Acetyl-phenyl-azo-acetylaceton [German]2,4-Pentanedione, 3-((p-acetylphenyl)azo)-4-Acetyl-phenyl-azo-acetylaceton3937-14-2
Database identifiers
- CAS
3937-14-2- PubChem CID
- 199278
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 75.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 354
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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