2-cyclopentylacetohydrazide

• ChemBase ID: 266913
• Molecular Formular: C7H14N2O
• Molecular Mass: 142.19886
• Monoisotopic Mass: 142.11061308
• SMILES: C(=O)(NN)CC1CCCC1
• Canonical SMILES: NNC(=O)CC1CCCC1
• InChI: InChI=1S/C7H14N2O/c8-9-7(10)5-6-3-1-2-4-6/h6H,1-5,8H2,(H,9,10)
• InChIKey: JUEVXKQPVUYIEJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-cyclopentylacetohydrazide
• IUPAC Traditional name: 2-cyclopentylacetohydrazide
• Synonyms: 2-cyclopentylacetohydrazide

Database IDs

• MDL Number: MFCD09742309
• PubChem SID: 164322823
• PubChem CID: 544019

CALCULATED PROPERTIES

• Acid pKa: 13.300523
• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 0.52822024
• LogD (pH = 7.4): 0.5307383
• Log P: 0.530771
• Molar Refractivity: 40.1263 cm^3
• Polarizability: 15.533293 Å^3
• Polar Surface Area: 55.12 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 82 - 84°C
• Hydrophobicity(logP): 0.467

Product Information

• Purity: 95%