dipropylamine hydrochloride

• ChemBase ID: 815814
• Molecular Formular: C6H16ClN
• Molecular Mass: 137.65094
• Monoisotopic Mass: 137.0971272
• SMILES: Cl.N(CCC)CCC
• Canonical SMILES: CCCNCCC.Cl
• InChI: InChI=1S/C6H15N.ClH/c1-3-5-7-6-4-2;/h7H,3-6H2,1-2H3;1H
• InChIKey: GAZIBGHLWYHBDT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dipropylamine hydrochloride
• IUPAC Traditional name: dipropylamine hydrochloride
• Synonyms: DIPROPYLAMINE HYDROCHLORIDE

Database IDs

• CAS Number: 5326-84-1

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.6721437
• LogD (pH = 7.4): -1.4326271
• Log P: 1.5657822
• Molar Refractivity: 33.2386 cm^3
• Polarizability: 13.342089 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%