2-aminopentanoic acid

• ChemBase ID: 102663
• Molecular Formular: C5H11NO2
• Molecular Mass: 117.14634
• Monoisotopic Mass: 117.0789786
• SMILES: CCCC(N)C(=O)O
• Canonical SMILES: CCCC(C(=O)O)N
• InChI: InChI=1S/C5H11NO2/c1-2-3-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)
• InChIKey: SNDPXSYFESPGGJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-aminopentanoic acid
• IUPAC Traditional name: 2-aminopentanoic acid; Nva
• Synonyms: DL-2-Aminopentanoic acid; DL-NORVALINE; Norvaline; (+/-)-2-Aminopentanoic acid; DL-2-Aminovaleric acid; 2-Aminopentanoic acid; (±)-2-Aminopentanoic acid; DL-Norvaline; DL-戊氨酸

Database IDs

• CAS Number: 6600-40-4; 760-78-1
• EC Number: 212-082-7
• MDL Number: MFCD00064421; MFCD00064420
• Beilstein Number: 1721163
• Merck Index: 146716
• PubChem SID: 24897829; 162088717
• PubChem CID: 824

CALCULATED PROPERTIES

• Acid pKa: 2.7136745
• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -1.8736948
• LogD (pH = 7.4): -1.8761299
• Log P: -1.8733752
• Molar Refractivity: 29.6223 cm^3
• Polarizability: 12.004493 Å^3
• Polar Surface Area: 63.32 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: >300°C

Safety Information

• Storage Condition: Room Temperature (15-30°C)
• German water hazard class: 3
• TSCA Listed: 是
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Purity: 98%

DETAILS

MP Biomedicals - 02102497

Crystalline

Sigma Aldrich - N7502

Biochem/physiol Actions
DL-Norvaline is a neurotransmitter.