2-hydroxy-2,2-diphenylacetohydrazide

• ChemBase ID: 27129
• Molecular Formular: C14H14N2O2
• Molecular Mass: 242.27316
• Monoisotopic Mass: 242.1055277
• SMILES: C(=O)(C(c1ccccc1)(c1ccccc1)O)NN
• Canonical SMILES: NNC(=O)C(c1ccccc1)(c1ccccc1)O
• InChI: InChI=1S/C14H14N2O2/c15-16-13(17)14(18,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,18H,15H2,(H,16,17)
• InChIKey: CAHGPINWWFMBKO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-hydroxy-2,2-diphenylacetohydrazide
• IUPAC Traditional name: 2-hydroxy-2,2-diphenylacetohydrazide
• Synonyms: 2-Hydroxy-2,2-diphenylacetohydrazide; BENZILIC HYDRAZIDE

Database IDs

• CAS Number: 13050-38-9
• MDL Number: MFCD00017082
• PubChem SID: 160990436
• PubChem CID: 95968

CALCULATED PROPERTIES

• Acid pKa: 11.25043
• H Acceptors: 3
• H Donor: 3
• LogD (pH = 5.5): 1.4533857
• LogD (pH = 7.4): 1.4540607
• Log P: 1.4541287
• Molar Refractivity: 69.7884 cm^3
• Polarizability: 26.845095 Å^3
• Polar Surface Area: 75.35 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

DETAILS

MP Biomedicals - 05204993

MP Biomedicals Rare Chemical collection