(3-methylbutyl)hydrazine dihydrochloride

• ChemBase ID: 257059
• Molecular Formular: C5H16Cl2N2
• Molecular Mass: 175.09994
• Monoisotopic Mass: 174.06905388
• SMILES: N(N)CCC(C)C.Cl.Cl
• Canonical SMILES: NNCCC(C)C.Cl.Cl
• InChI: InChI=1S/C5H14N2.2ClH/c1-5(2)3-4-7-6;;/h5,7H,3-4,6H2,1-2H3;2*1H
• InChIKey: WPNFNHOCSSMSOG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

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

Database IDs

• MDL Number: MFCD22378800
• PubChem SID: 164312969
• PubChem CID: 19771531

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 0.3183352
• LogD (pH = 7.4): 0.7897905
• Log P: 0.80080384
• Molar Refractivity: 43.3179 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: 134 - 136°C
• Hydrophobicity(logP): 0.922

Product Information

• Purity: 95%