2,3-dimethylbenzohydrazide

• ChemBase ID: 308859
• Molecular Formular: C9H12N2O
• Molecular Mass: 164.20438
• Monoisotopic Mass: 164.09496301
• SMILES: c1(C(=O)NN)c(c(ccc1)C)C
• Canonical SMILES: Cc1c(cccc1C)C(=O)NN
• InChI: InChI=1S/C9H12N2O/c1-6-4-3-5-8(7(6)2)9(12)11-10/h3-5H,10H2,1-2H3,(H,11,12)
• InChIKey: MGVMLDWHIXDMJI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,3-dimethylbenzohydrazide
• IUPAC Traditional name: 2,3-dimethylbenzohydrazide
• Synonyms: 2,3-dimethylbenzohydrazide

Database IDs

• CAS Number: 219783-74-1
• MDL Number: MFCD09737327

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.5533144
• LogD (pH = 7.4): 1.5542413
• Log P: 1.5542532
• Molar Refractivity: 49.7029 cm^3
• Polarizability: 18.112036 Å^3
• Polar Surface Area: 55.12 Å^2