6-cyclopropylpyridazin-3-amine

• ChemBase ID: 275828
• Molecular Formular: C7H9N3
• Molecular Mass: 135.16646
• Monoisotopic Mass: 135.0796473
• SMILES: n1nc(N)ccc1C1CC1
• Canonical SMILES: Nc1ccc(nn1)C1CC1
• InChI: InChI=1S/C7H9N3/c8-7-4-3-6(9-10-7)5-1-2-5/h3-5H,1-2H2,(H2,8,10)
• InChIKey: VOZUGSUMEYWXPY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-cyclopropylpyridazin-3-amine
• IUPAC Traditional name: 6-cyclopropylpyridazin-3-amine
• Synonyms: 6-cyclopropylpyridazin-3-amine

Database IDs

• MDL Number: MFCD09836134
• PubChem SID: 164331738
• PubChem CID: 44558109

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): 0.41946533
• LogD (pH = 7.4): 0.45206946
• Log P: 0.45250142
• Molar Refractivity: 40.769 cm^3
• Polarizability: 14.402285 Å^3
• Polar Surface Area: 51.8 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 135 - 137°C
• Hydrophobicity(logP): 0.484

Product Information

• Purity: 95%