(αS)-4-Bromo-α-(trifluoromethyl)benzenemethanol

Name: (αS)-4-Bromo-α-(trifluoromethyl)benzenemethanol
Brand: ChemScene
Availability: InStock
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CAS No. 80418-13-9
Cat. No. CS-0093785
Purity≥98%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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(αS)-4-Bromo-α-(trifluoromethyl)benzenemethanol|CS-0093785

Structure of 80418-13-9

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Description

This bench-stable, moisture-tolerant chiral building block features a trifluoromethyl group and a brominated aromatic ring, enabling efficient functionalization in asymmetric synthesis. The α-hydroxyl moiety facilitates direct coupling or oxidation to carboxylic acid derivatives, while the stereogenic center supports enantioselective transformations.

Application

(αS)-4-Bromo-α-(trifluoromethyl)benzenemethanol serves as a valuable chiral building block in synthetic organic chemistry, enabling stereoselective transformations through its well-defined configuration and functional group compatibility. The bromo and trifluoromethyl groups provide orthogonal reactivity for cross-coupling and electrophilic functionalization, while the benzylic alcohol facilitates derivatization or protection. Bench-stable and readily purified by standard methods, it functions effectively in multi-step syntheses requiring controlled stereochemistry and enhanced metabolic stability.

General Information

CAS No. 80418-13-9
Cat. No. CS-0093785
Purity ≥98%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₆BrF₃O
Molecular Weight 255.03
Synonym(s) (S)-1-(4-bromophenyl)-2,2,2-trifluoroethanol
SMILES FC(F)(F)[C@@H](O)C1=CC=C(Br)C=C1

Computational Chemistry Data

TPSA 20.23
LogP 3.0448
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 1

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362-P405-P501

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Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Building Blocks Skeleton Chiral compounds Chiral Building Blocks

Key Words

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(αS)-4-Bromo-α-(trifluoromethyl)benzenemethanol

CAS No. 80418-13-9

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