pentan-3-ylhydrazine dihydrochloride

• ChemBase ID: 89865
• Molecular Formular: C5H16Cl2N2
• Molecular Mass: 175.09994
• Monoisotopic Mass: 174.06905388
• SMILES: NNC(CC)CC.Cl.Cl
• Canonical SMILES: CCC(NN)CC.Cl.Cl
• InChI: InChI=1S/C5H14N2.2ClH/c1-3-5(4-2)7-6;;/h5,7H,3-4,6H2,1-2H3;2*1H
• InChIKey: SODDJJRARFWDPC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: pentan-3-ylhydrazine dihydrochloride
• IUPAC Traditional name: pentan-3-ylhydrazine dihydrochloride
• Synonyms: 3-Hydrazinopentane dihydrochloride; (Pent-3-yl)hydrazine dihydrochloride; pentan-3-ylhydrazine dihydrochloride

Database IDs

• MDL Number: MFCD12401615
• PubChem SID: 162076720
• PubChem CID: 45933890

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 0.39300907
• LogD (pH = 7.4): 0.9915248
• Log P: 1.0083135
• Molar Refractivity: 43.1111 cm^3
• Polarizability: 12.804681 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 60-80°C
• Hydrophobicity(logP): 0.832

Safety Information

• Storage Warning: Toxic/Irritant/Store under Argon/Keep Cold

Product Information

• Purity: 95%