5-chloro-2-methoxybenzohydrazide

• ChemBase ID: 306449
• Molecular Formular: C8H9ClN2O2
• Molecular Mass: 200.62226
• Monoisotopic Mass: 200.03525522
• SMILES: c1(C(=O)NN)c(ccc(c1)Cl)OC
• Canonical SMILES: COc1ccc(cc1C(=O)NN)Cl
• InChI: InChI=1S/C8H9ClN2O2/c1-13-7-3-2-5(9)4-6(7)8(12)11-10/h2-4H,10H2,1H3,(H,11,12)
• InChIKey: GNYCSXNVIRAAEC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5-chloro-2-methoxybenzohydrazide
• IUPAC Traditional name: 5-chloro-2-methoxybenzohydrazide
• Synonyms: 5-chloro-2-methoxybenzohydrazide

Database IDs

• CAS Number: 33977-11-6
• MDL Number: MFCD02236615

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 0.9730541
• LogD (pH = 7.4): 0.97377396
• Log P: 0.97378385
• Molar Refractivity: 50.8885 cm^3
• Polarizability: 19.03527 Å^3
• Polar Surface Area: 64.35 Å^2