2-{[5-(2-fluorophenyl)-4-(4-fluorophenyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid

Name: 2-{[5-(2-fluorophenyl)-4-(4-fluorophenyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Brand: ChemScene
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CAS No. 733031-05-5
Cat. No. CS-0220910
Molecule weight347.34
Purity≥95%
MDL No.None

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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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2-{[5-(2-fluorophenyl)-4-(4-fluorophenyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid|CS-0220910

Structure of 733031-05-5

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General Information

CAS No. 733031-05-5
Cat. No. CS-0220910
Purity ≥95%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₆H₁₁F₂N₃O₂S
Molecular Weight 347.34
Synonym(s) None
SMILES O=C(O)CSC1=NN=C(C2=CC=CC=C2F)N1C3=CC=C(F)C=C3

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 68.01
LogP 3.3892
H_Acceptors 5
H_Donors 1
Rotatable_Bonds 5

Other Classifications

Building Blocks Functional Group Thioether

Building Blocks Functional Group Carboxylic Acid

Building Blocks Skeleton Aromatic heterocycle compounds Triazole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

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2-{[5-(2-fluorophenyl)-4-(4-fluorophenyl)-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid

CAS No. 733031-05-5

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