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

Name: 2-{[5-(2-fluorophenyl)-4-phenyl-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid
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CAS No. 730973-18-9
Cat. No. CS-0221242
Molecule weight329.35
Purity≥97%
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-phenyl-4h-1,2,4-triazol-3-yl]sulfanyl}acetic acid|CS-0221242

Structure of 730973-18-9

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General Information

CAS No. 730973-18-9
Cat. No. CS-0221242
Purity ≥97%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₆H₁₂FN₃O₂S
Molecular Weight 329.35
Synonym(s) None
SMILES O=C(O)CSC1=NN=C(C2=CC=CC=C2F)N1C3=CC=CC=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 3.2501
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

Key Words

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

CAS No. 730973-18-9

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