6-(Trifluoromethyl)benzo[d]thiazole

Name: 6-(Trifluoromethyl)benzo[d]thiazole
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CAS No. 131106-70-2
Cat. No. CS-0103380
Purity≥96%
MDL No.MFCD06659653

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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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6-(Trifluoromethyl)benzo[d]thiazole|CS-0103380

Structure of 131106-70-2

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General Information

CAS No. 131106-70-2
Cat. No. CS-0103380
Purity ≥96%
MDL No. MFCD06659653
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₄F₃NS
Molecular Weight None
Synonym(s) 6-Trifluoromethylbenzothiazole
SMILES FC(F)(F)C1=CC=C2N=CSC2=C1

Description

6-(Trifluoromethyl)benzo[d]thiazole delivers a potent electron-deficient heteroaromatic scaffold ideal for medicinal chemistry and materials science. The trifluoromethyl group enhances metabolic stability and modulates electronic properties, while the fused thiazole ring provides a rigid, planar structure conducive to π-stacking interactions. This compound integrates readily into bioactive molecules and functional materials under standard conditions.

Application

6-(Trifluoromethyl)benzo[d]thiazole serves as a versatile heterocyclic building block in medicinal chemistry and materials science. Its electron-deficient trifluoromethyl group enhances metabolic stability and modulates electronic properties, while the benzo[d]thiazole core provides a rigid, planar scaffold ideal for π-stacking interactions. The molecule exhibits excellent bench stability, tolerates diverse functional groups, and participates reliably in palladium-catalyzed cross-coupling reactions, facilitating efficient access to complex molecular architectures.

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 12.89
LogP 3.3151
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 0

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Benzothiazole compounds

Key Words

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6-(Trifluoromethyl)benzo[d]thiazole

CAS No. 131106-70-2

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