Butanedioic acid, mono[2-(3-methyl-4-nitrobenzoyl)hydrazide]
4-[2-(3-methyl-4-nitrobenzoyl)hydrazinyl]-4-oxobutanoic acid
Also Known As: AK-968/41026504|butanedioic acid, mono[2-(3-methyl-4-nitrobenzoyl)hydrazide]|3-[[(3-methyl-4-nitro-benzoyl)amino]carbamoyl]propanoic Acid|4-(2-{4-nitro-3-methylbenzoyl}hydrazino)-4-oxobutanoic acid|4-[2-(3-methyl-4-nitrobenzoyl)hydrazinyl]-4-oxobutanoic acid|3-{N-[(3-methyl-4-nitrophenyl)carbonylamino]carbamoyl}propanoic acid|4-[2-(3-METHYL-4-NITROBENZOYL)HYDRAZINO]-4-OXOBUTANOIC ACID|4-{2-[(3-methyl-4-nitrophenyl)carbonyl]hydrazinyl}-4-oxobutanoic acid
| Molecular Formula | C12H13N3O6 |
|---|---|
| Molecular Weight | 295.08044 g/mol |
| LogP | 0.52902 |
| Topological Polar Surface Area | 138.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 295.08044 |
| Monoisotopic Mass | 295.08044 |
| Heavy Atoms | 21 |
| Complexity | 598.6556 |
Chemical Identifiers
| CAS Number | 445258-06-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=O)NNC(=O)CCC(=O)O)[N+](=O)[O-] |
Product Overview
Butanedioic acid, mono[2-(3-methyl-4-nitrobenzoyl)hydrazide] (CAS 445258-06-0), with molecular formula C12H13N3O6 and molecular weight 295.08044 g/mol. IUPAC: 4-[2-(3-methyl-4-nitrobenzoyl)hydrazinyl]-4-oxobutanoic acid.