cyclopropylmethanamine hydrobromide

• ChemBase ID: 259240
• Molecular Formular: C4H10BrN
• Molecular Mass: 152.0329
• Monoisotopic Mass: 150.99966133
• SMILES: C1CC1CN.Br
• Canonical SMILES: NCC1CC1.Br
• InChI: InChI=1S/C4H9N.BrH/c5-3-4-1-2-4;/h4H,1-3,5H2;1H
• InChIKey: SXRZNLRIALLBMS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: cyclopropylmethanamine hydrobromide
• IUPAC Traditional name: cyclopropylmethanamine hydrobromide
• Synonyms: cyclopropylmethanamine hydrobromide

Database IDs

• MDL Number: MFCD11857998
• PubChem SID: 164315150
• PubChem CID: 45791407

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -2.869171
• LogD (pH = 7.4): -2.4582562
• Log P: 0.1551184
• Molar Refractivity: 21.8608 cm^3
• Polarizability: 8.905697 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 191 - 193°C
• Hydrophobicity(logP): 0.309

Product Information

• Purity: 95%