(2R)-2-amino-3-cyclopentylpropanoic acid

• ChemBase ID: 812622
• Molecular Formular: C8H15NO2
• Molecular Mass: 157.2102
• Monoisotopic Mass: 157.11027873
• SMILES: C(=O)([C@@H](CC1CCCC1)N)O
• Canonical SMILES: N[C@@H](C(=O)O)CC1CCCC1
• InChI: InChI=1S/C8H15NO2/c9-7(8(10)11)5-6-3-1-2-4-6/h6-7H,1-5,9H2,(H,10,11)/t7-/m1/s1
• InChIKey: KDYAKYRBGLKMAK-SSDOTTSWSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2R)-2-amino-3-cyclopentylpropanoic acid
• IUPAC Traditional name: (2R)-2-amino-3-cyclopentylpropanoic acid
• Synonyms: (R)-2-AMINO-3-CYCLOPENTYLPROPANOIC ACID

Database IDs

• CAS Number: 58717-02-5

CALCULATED PROPERTIES

• Acid pKa: 2.668427
• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -1.161299
• LogD (pH = 7.4): -1.1638508
• Log P: -1.161021
• Molar Refractivity: 41.5707 cm^3
• Polarizability: 16.785397 Å^3
• Polar Surface Area: 63.32 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%