2-hydroxy-3-methoxybenzohydrazide

• ChemBase ID: 262244
• Molecular Formular: C8H10N2O3
• Molecular Mass: 182.1766
• Monoisotopic Mass: 182.06914219
• SMILES: c1(c(c(OC)ccc1)O)C(=O)NN
• Canonical SMILES: NNC(=O)c1cccc(c1O)OC
• InChI: InChI=1S/C8H10N2O3/c1-13-6-4-2-3-5(7(6)11)8(12)10-9/h2-4,11H,9H2,1H3,(H,10,12)
• InChIKey: IZKGGRKOUPRINU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-hydroxy-3-methoxybenzohydrazide
• IUPAC Traditional name: 2-hydroxy-3-methoxybenzohydrazide
• Synonyms: 2-hydroxy-3-methoxybenzohydrazide

Database IDs

• MDL Number: MFCD09946516
• PubChem SID: 164318154
• PubChem CID: 21566416

CALCULATED PROPERTIES

• Acid pKa: 8.655958
• H Acceptors: 4
• H Donor: 3
• LogD (pH = 5.5): 0.7154986
• LogD (pH = 7.4): 0.6929183
• Log P: 0.7161738
• Molar Refractivity: 48.0646 cm^3
• Polarizability: 17.765137 Å^3
• Polar Surface Area: 84.58 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 144 - 146°C
• Hydrophobicity(logP): 0.694

Product Information

• Purity: 95%