Cas no 340-06-7 ((S)-(+)-α-(Trifluoromethyl)benzyl Alcohol)

(S)-(+)-α-(Trifluoromethyl)benzyl Alcohol is a chiral aromatic alcohol featuring a trifluoromethyl group adjacent to the hydroxyl-bearing carbon. This compound is widely utilized as a key intermediate in asymmetric synthesis, particularly in the preparation of pharmaceuticals and agrochemicals due to its enantiomeric purity and structural versatility. The trifluoromethyl group enhances metabolic stability and lipophilicity, making it valuable in drug design. Its high optical purity ensures consistent performance in stereoselective reactions. The compound is typically employed in catalytic hydrogenation, nucleophilic substitution, and as a chiral auxiliary. Proper handling under inert conditions is recommended to preserve its stability and reactivity.
(S)-(+)-α-(Trifluoromethyl)benzyl Alcohol structure
340-06-7 structure
Product Name:(S)-(+)-α-(Trifluoromethyl)benzyl Alcohol
CAS No:340-06-7
MF:C8H7F3O
MW:176.135792970657
MDL:MFCD00077845
CID:319815
PubChem ID:1472401
Update Time:2025-05-21

(S)-(+)-α-(Trifluoromethyl)benzyl Alcohol Chemical and Physical Properties

Names and Identifiers

    • (S)-(+)-alpha-(Trifluoromethyl)benzyl Alcohol
    • (S)-(+)-α-(Trifluoromethyl)benzyl alcohol
    • (S)-2,2,2-TRIFLUORO-1-PHENYL-ETHANOL
    • (1S)-2,2,2-trifluoro-1-phenylethanol
    • (S)-(+)-&alpha
    • (S)-(+)-1-Phenyl-2,2,2-trifluoroethanol
    • (S)-2,2,2-Trifluoro-1-phenylethanol
    • (1S)-2,2,2-trifluoro-1-phenylethan-1-ol
    • (S)-1-Phenyl-2,2,2-trifluoroethanol
    • (+)-Phenyl(trifluoromethyl)carbinol
    • PubChem15591
    • (s)-1-phenyltrifluoroethanol
    • VNOMEAQPOMDWSR-ZETCQYMHSA-N
    • BDBM108244
    • (S)-a-(trifluoromethyl)benzyl alcohol
    • NE19833
    • MCULE-
    • (1S)-2,2,2-Trifluoro-1-phenyl-ethanol
    • J-019417
    • CS-0034203
    • (1S)-(+)-1-Phenyl-2,2,2-trifluoroethan-1-ol
    • (S)-(+)-alpha-(Trifluoromethyl)benzyl alcohol, puriss., >=99.0% (sum of enantiomers, GC)
    • AS-10251
    • 340-06-7
    • MFCD00077845
    • (S)-(+)-alpha-(Trifluoromethyl)benzyl alcohol, 99%
    • NS00079290
    • P1368
    • SCHEMBL1669527
    • (S)-(+)- alpha -(Trifluoromethyl)benzyl alcohol
    • AKOS006240681
    • T72326
    • Z1198169138
    • (1S)‐2,2,2‐trifluoro‐1‐phenylethanol (Hit 12)
    • EN300-111501
    • A-(TRIFLUOROMETHYL)BENZYL ALCOHOL
    • (S)-(+)-
    • (S)-(+)-α-(Trifluoromethyl)benzyl Alcohol
    • MDL: MFCD00077845
    • Inchi: 1S/C8H7F3O/c9-8(10,11)7(12)6-4-2-1-3-5-6/h1-5,7,12H/t7-/m0/s1
    • InChI Key: VNOMEAQPOMDWSR-ZETCQYMHSA-N
    • SMILES: FC([C@H](C1C=CC=CC=1)O)(F)F

Computed Properties

  • Exact Mass: 176.04491
  • Monoisotopic Mass: 176.04489933g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 138
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.2
  • Topological Polar Surface Area: 20.2

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.3?g/mL?at 25?°C(lit.)
  • Boiling Point: 127°C(lit.)
  • Flash Point: Fahrenheit: 183.2 ° f < br / > Celsius: 84 ° C < br / >
  • Refractive Index: n20/D 1.462(lit.)
  • PSA: 20.23
  • Solubility: Not determined
  • Optical Activity: [α]20/D +31.3±0.5°, neat

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
S161231-1G
(S)-(+)-α-(Trifluoromethyl)benzyl Alcohol
340-06-7 >98.0%(GC)
1g
¥1075.90 2023-09-01
SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd.
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(S)-(+)-α-(Trifluoromethyl)benzyl Alcohol Suppliers

Amadis Chemical Company Limited
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(CAS:340-06-7)(S)-(+)-α-(Trifluoromethyl)benzyl Alcohol
Order Number:A943006
Stock Status:in Stock
Quantity:25g/5g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 15:45
Price ($):598.0/185.0

(S)-(+)-α-(Trifluoromethyl)benzyl Alcohol Related Literature

Additional information on (S)-(+)-α-(Trifluoromethyl)benzyl Alcohol

(S)-(+)-α-(Trifluoromethyl)benzyl Alcohol: A Comprehensive Overview

(S)-(+)-α-(Trifluoromethyl)benzyl Alcohol, also known by its CAS number 340-06-7, is a compound of significant interest in the fields of organic chemistry, pharmaceuticals, and materials science. This compound is characterized by its unique structure, which includes a trifluoromethyl group attached to a benzyl alcohol moiety. The (S) configuration denotes the stereochemistry of the molecule, which plays a crucial role in its biological activity and chemical reactivity.

The synthesis of (S)-(+)-α-(Trifluoromethyl)benzyl Alcohol has been extensively studied, with researchers exploring various methodologies to achieve high enantiomeric excess. Recent advancements in asymmetric catalysis have enabled more efficient and environmentally friendly production methods. For instance, the use of chiral catalysts such as proline derivatives has been reported to facilitate the asymmetric reduction of ketones to alcohols, yielding this compound with excellent stereoselectivity.

In terms of physical and chemical properties, (S)-(+)-α-(Trifluoromethyl)benzyl Alcohol exhibits a melting point of approximately -5°C and a boiling point around 115°C under standard conditions. Its solubility in water is moderate, making it suitable for various applications in both aqueous and organic solvents. The trifluoromethyl group imparts unique electronic properties to the molecule, enhancing its stability and reactivity in certain chemical transformations.

The biological activity of this compound has been a focal point of recent research. Studies have demonstrated that (S)-(+)-α-(Trifluoromethyl)benzyl Alcohol possesses potent antioxidant properties, which could be harnessed in the development of new therapeutic agents for diseases associated with oxidative stress, such as neurodegenerative disorders. Additionally, its ability to act as a chiral building block in organic synthesis has made it an invaluable tool in drug discovery and development.

In the context of materials science, this compound has shown promise as a precursor for the synthesis of advanced polymers and coatings. Its trifluoromethyl group contributes to the hydrophobicity and thermal stability of materials derived from it, making it suitable for applications in high-performance adhesives and electronics.

Recent research has also explored the use of (S)-(+)-α-(Trifluoromethyl)benzyl Alcohol in green chemistry initiatives. For example, it has been employed as a sustainable starting material for the synthesis of bioactive compounds, reducing reliance on hazardous reagents and improving overall process efficiency.

In conclusion, (S)-(+)-α-(Trifluoromethyl)benzyl Alcohol (CAS No: 340-06-7) is a versatile compound with diverse applications across multiple disciplines. Its unique structure, coupled with advancements in synthetic methodologies and biological applications, positions it as a key player in contemporary chemical research. As ongoing studies continue to uncover new potentials for this compound, its role in driving innovation across industries is expected to grow significantly.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:340-06-7)(S)-(+)-α-(Trifluoromethyl)benzyl Alcohol
A943006
Purity:99%/99%
Quantity:25g/5g
Price ($):598.0/185.0
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