1-cyclopentylcyclopropan-1-amine hydrochloride

• ChemBase ID: 144030
• Molecular Formular: C8H16ClN
• Molecular Mass: 161.67234
• Monoisotopic Mass: 161.0971272
• SMILES: C1CCC(C1)C1(CC1)N.Cl
• Canonical SMILES: NC1(CC1)C1CCCC1.Cl
• InChI: InChI=1S/C8H15N.ClH/c9-8(5-6-8)7-3-1-2-4-7;/h7H,1-6,9H2;1H
• InChIKey: SHBAMDDXOHPKQX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-cyclopentylcyclopropan-1-amine hydrochloride
• IUPAC Traditional name: 1-cyclopentylcyclopropan-1-amine hydrochloride
• Synonyms: (1-Cyclopentylcyclopropyl)amine hydrochloride

Database IDs

• MDL Number: MFCD18071228
• PubChem SID: 162238247
• PubChem CID: 53398896

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.5926199
• LogD (pH = 7.4): -1.2430902
• Log P: 1.433589
• Molar Refractivity: 38.1636 cm^3
• Polarizability: 15.551486 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Empirical Formula (Hill Notation): C8H16ClN

DETAILS

Sigma Aldrich - CBR00892

Other Notes
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Legal Information
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