(R)-cyclopropyl(phenyl)methanamine hydrochloride

• ChemBase ID: 288591
• Molecular Formular: C10H14ClN
• Molecular Mass: 183.67786
• Monoisotopic Mass: 183.08147713
• SMILES: N[C@H](C1CC1)c1ccccc1.Cl
• Canonical SMILES: N[C@@H](c1ccccc1)C1CC1.Cl
• InChI: InChI=1S/C10H13N.ClH/c11-10(9-6-7-9)8-4-2-1-3-5-8;/h1-5,9-10H,6-7,11H2;1H/t10-;/m0./s1
• InChIKey: QTUNRTDRPMOQNG-PPHPATTJSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (R)-cyclopropyl(phenyl)methanamine hydrochloride
• IUPAC Traditional name: (R)-cyclopropyl(phenyl)methanamine hydrochloride
• Synonyms: (R)-Cyclopropyl(phenyl)methanamine hydrochloride

Database IDs

• PubChem SID: 180674122
• PubChem CID: 45072325

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.0713054
• LogD (pH = 7.4): -0.37788
• Log P: 1.9393586
• Molar Refractivity: 46.1436 cm^3
• Polarizability: 18.5436 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%