4-(5-Methyl-3-phenylisoxazol-4-yl)benzenesulfonic Acid Dihydrate (Valdecoxib Sulfonic Acid Dihydrate)
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- structure.search.product.name 4-(5-Methyl-3-phenylisoxazol-4-yl)benzenesulfonic Acid Dihydrate (Valdecoxib Sulfonic Acid Dihydrate)
- Product Code: MM0937.04
- CAS Number: 2987295-53-2
- Brand: Mikromol
Product Overview
Product Code
MM0937.04
CAS Number
Product Format
Neat
Molecular Formula
C16 H13 N O4 S . 2 H2 O
Molecular Weight
351.37
API Family
ValdecoxibProduct Categories
Mikromol, Impurity Reference Materials , Non-steroidal anti-inflammatory drugs (NSAIDs), Analgesics
Product Type
ImpurityDrug Type
Analgesics
Documentation
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Product Information
Analyte Data
Analyte Name
4-(5-Methyl-3-phenylisoxazol-4-yl)benzenesulfonic Acid Dihydrate
CAS Number
2987295-53-2
Molecular Formula
C16 H13 N O4 S . 2 H2 O
Molecular Weight
351.37
Accurate Mass
351.0777
SMILES
O.O.Cc1onc(c2ccccc2)c1c3ccc(cc3)S(=O)(=O)O
InChI
InChI=1S/C16H13NO4S.2H2O/c1-11-15(12-7-9-14(10-8-12)22(18,19)20)16(17-21-11)13-5-3-2-4-6-13;;/h2-10H,1H3,(H,18,19,20);2*1H2
IUPAC
4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)benzenesulfonic acid;dihydrate
Product Data
Storage Temperature
+5°C
Shipping Temperature
Room Temperature
Country of Origin
GERMANY
Product Type
Impurity
Product Format
Neat
Impurity Type
Intermediate
API Family