2H-1,3-benzodioxol-5-ylhydrazine

• ChemBase ID: 306669
• Molecular Formular: C7H8N2O2
• Molecular Mass: 152.15062
• Monoisotopic Mass: 152.05857751
• SMILES: c12cc(NN)ccc1OCO2
• Canonical SMILES: NNc1ccc2c(c1)OCO2
• InChI: InChI=1S/C7H8N2O2/c8-9-5-1-2-6-7(3-5)11-4-10-6/h1-3,9H,4,8H2
• InChIKey: KICYFFZBYGXTAF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2H-1,3-benzodioxol-5-ylhydrazine
• IUPAC Traditional name: 2H-1,3-benzodioxol-5-ylhydrazine
• Synonyms: 1,3-benzodioxol-5-ylhydrazine

Database IDs

• CAS Number: 62646-09-7
• MDL Number: MFCD07786366

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): 0.80276895
• LogD (pH = 7.4): 0.98522
• Log P: 0.98812187
• Molar Refractivity: 41.5316 cm^3
• Polarizability: 15.372283 Å^3
• Polar Surface Area: 56.51 Å^2