279889

(S)-(+)-2-Phenylbutyric acid

99%

• Linear Formula: C₂H₅CH(C₆H₅)CO₂H
• CAS Number: 4286-15-1
• Molecular Weight: 164.20
• Beilstein/REAXYS Number: 2045208
• MDL number: MFCD00063164
• UNSPSC Code: 12352002
• PubChem Substance ID: 24856913
• NACRES: NA.22

Properties

• Quality Level: 100
• assay: 99%
• optical activity: [α]19/D +92°, c = 0.9 in toluene
• refractive index: n20/D 1.516 (lit.)
• bp: 98-100 °C/0.3 mmHg (lit.)
• density: 1.055 g/mL at 25 °C (lit.)
• functional group: carboxylic acid; phenyl
• SMILES string: CC[C@H](C(O)=O)c1ccccc1
• InChI: 1S/C10H12O2/c1-2-9(10(11)12)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,11,12)/t9-/m0/s1
• InChI key: OFJWFSNDPCAWDK-VIFPVBQESA-N

Description

Application

Chiral building block. Resolving agent

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H302
• Hazard Classifications: Acute Tox. 4 Oral
• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 3
• flash_point_f: 230.0 °F - closed cup
• flash_point_c: 110 °C - closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter