4-[1-[4-(Aminosulfonyl)phenyl]-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzoic Acid
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- structure.search.product.name 4-[1-[4-(Aminosulfonyl)phenyl]-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzoic Acid
- Product Code: MM0344.03
- CAS Number: 170571-01-4
- Brand: Mikromol
Product Overview
Product Code
MM0344.03
CAS Number
Product Format
Neat
Molecular Formula
C17 H12 F3 N3 O4 S
Molecular Weight
411.36
API Family
CelecoxibProduct Categories
Analgesics, Non-steroidal anti-inflammatory drugs (NSAIDs), Anticancerous, Impurity Reference Materials , Mikromol
Product Type
ImpurityDrug Type
Analgesics
Documentation
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Product Information
Analyte Data
Analyte Name
Celecoxib Carboxylic Acid
CAS Number
170571-01-4
Molecular Formula
C17 H12 F3 N3 O4 S
Molecular Weight
411.36
Accurate Mass
411.0501
SMILES
NS(=O)(=O)c1ccc(cc1)n2nc(cc2c3ccc(cc3)C(=O)O)C(F)(F)F
InChI
InChI=1S/C17H12F3N3O4S/c18-17(19,20)15-9-14(10-1-3-11(4-2-10)16(24)25)23(22-15)12-5-7-13(8-6-12)28(21,26)27/h1-9H,(H,24,25)(H2,21,26,27)
IUPAC
4-[2-(4-sulfamoylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]benzoic acid
Product Data
Storage Temperature
+5°C
Shipping Temperature
Room Temperature
Country of Origin
GERMANY
Product Type
Impurity
Product Format
Neat
API Family