79231

(R)-(−)-α-(Trifluoromethyl)benzyl alcohol

puriss., ≥99.0% (sum of enantiomers, GC)

• Synonym(s): (−)-Phenyl(trifluoromethyl)carbinol, (R)-(−)-1-Phenyl-2,2,2-trifluoroethanol
• Linear Formula: C₆H₅CH(CF₃)OH
• CAS Number: 10531-50-7
• Molecular Weight: 176.14
• Beilstein/REAXYS Number: 2413959
• EC Number: 234-094-1
• MDL number: MFCD00077844
• UNSPSC Code: 12352002
• PubChem Substance ID: 57652780

Properties

• grade: puriss.
• assay: ≥99.0% (sum of enantiomers, GC)
• optical activity: [α]20/D −31.5±0.5°, neat
• optical purity: enantiomeric ratio: ≥98:2 (GC)
• refractive index: n20/D 1.459 (lit.); n20/D 1.462
• bp: 73-76 °C/9 mmHg (lit.)
• mp: 20 °C (lit.)
• density: 1.300 g/mL at 20 °C (lit.)
• SMILES string: O[C@H](c1ccccc1)C(F)(F)F
• InChI: 1S/C8H7F3O/c9-8(10,11)7(12)6-4-2-1-3-5-6/h1-5,7,12H/t7-/m1/s1
• InChI key: VNOMEAQPOMDWSR-SSDOTTSWSA-N

Description

Other Notes

Chiral solvent for the determination of enantiomeric composition by NMR ; Chiral auxiliary

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H315,H319,H335
• pcodes: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 3
• flash_point_f: 188.6 °F - closed cup
• flash_point_c: 87 °C - closed cup
• ppe: Eyeshields, Gloves, type ABEK (EN14387) respirator filter