(oxolan-3-ylmethyl)hydrazine hydrochloride

• ChemBase ID: 258467
• Molecular Formular: C5H13ClN2O
• Molecular Mass: 152.62252
• Monoisotopic Mass: 152.07164073
• SMILES: O1CC(CNN)CC1.Cl
• Canonical SMILES: NNCC1COCC1.Cl
• InChI: InChI=1S/C5H12N2O.ClH/c6-7-3-5-1-2-8-4-5;/h5,7H,1-4,6H2;1H
• InChIKey: BFZAOHNFSPHEKJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (oxolan-3-ylmethyl)hydrazine hydrochloride
• IUPAC Traditional name: (oxolan-3-ylmethyl)hydrazine hydrochloride
• Synonyms: 1-(oxolan-3-ylmethyl)hydrazine hydrochloride

Database IDs

• MDL Number: MFCD11857812
• PubChem SID: 164314377
• PubChem CID: 43810767

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%