4-((2,2,2-Trifluoroethyl)thio)benzoic acid

Name: 4-((2,2,2-Trifluoroethyl)thio)benzoic acid
Brand: ChemScene
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CAS No. 954562-94-8
Cat. No. CS-0578183
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+

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

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4-((2,2,2-Trifluoroethyl)thio)benzoic acid|CS-0578183

Structure of 954562-94-8

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General Information

CAS No. 954562-94-8
Cat. No. CS-0578183
Purity ≥98%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₇F₃O₂S
Molecular Weight 236.21
Synonym(s) 4-[(2,2,2-Trifluoroethyl)sulphanyl]benzoic acid
SMILES C1=CC(=CC=C1C(=O)O)SCC(F)(F)F

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 37.3
LogP 3.0392
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Thioether

Building Blocks Functional Group Carboxylic Acid

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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4-((2,2,2-Trifluoroethyl)thio)benzoic acid

CAS No. 954562-94-8

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