(oxolan-3-ylmethyl)hydrazine dihydrochloride

• ChemBase ID: 266198
• Molecular Formular: C5H14Cl2N2O
• Molecular Mass: 189.08346
• Monoisotopic Mass: 188.04831844
• SMILES: O1CC(CNN)CC1.Cl.Cl
• Canonical SMILES: NNCC1COCC1.Cl.Cl
• InChI: InChI=1S/C5H12N2O.2ClH/c6-7-3-5-1-2-8-4-5;;/h5,7H,1-4,6H2;2*1H
• InChIKey: YMNWVBWQLXIPSD-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (oxolan-3-ylmethyl)hydrazine dihydrochloride
• IUPAC Traditional name: (oxolan-3-ylmethyl)hydrazine dihydrochloride
• Synonyms: (oxolan-3-ylmethyl)hydrazine dihydrochloride

Database IDs

• MDL Number: MFCD15209614
• PubChem SID: 164322108
• PubChem CID: 47002621

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -1.2508491
• LogD (pH = 7.4): -0.80151594
• Log P: -0.7913394
• Molar Refractivity: 43.4894 cm^3
• Polarizability: 12.759184 Å^3
• Polar Surface Area: 47.28 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -1.242

Product Information

• Purity: 95%