(4-methoxy-2-nitrophenyl)hydrazine

• ChemBase ID: 238648
• Molecular Formular: C7H9N3O3
• Molecular Mass: 183.16466
• Monoisotopic Mass: 183.06439116
• SMILES: [N+](=O)(c1c(ccc(c1)OC)NN)[O-]
• Canonical SMILES: COc1ccc(c(c1)[N+](=O)[O-])NN
• InChI: InChI=1S/C7H9N3O3/c1-13-5-2-3-6(9-8)7(4-5)10(11)12/h2-4,9H,8H2,1H3
• InChIKey: WMJOCGQUSXPCEP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (4-methoxy-2-nitrophenyl)hydrazine
• IUPAC Traditional name: (4-methoxy-2-nitrophenyl)hydrazine
• Synonyms: (4-methoxy-2-nitrophenyl)hydrazine

Database IDs

• MDL Number: MFCD00460632
• PubChem SID: 164294558
• PubChem CID: 12339340

CALCULATED PROPERTIES

• Polar Surface Area: 93.1 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true
• Acid pKa: 15.061711
• H Acceptors: 5
• H Donor: 2
• LogD (pH = 5.5): 1.7263463
• LogD (pH = 7.4): 1.7958496
• Log P: 1.7972014
• Molar Refractivity: 49.5526 cm^3
• Polarizability: 17.346804 Å^3

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.729

Product Information

• Purity: 95%