Benoxaprofen 1,3-Butylene Glycol Esters (Mixture of Regio- and Stereoisomers)
Product Code
MM1828.04-0025
Product Format
Neat
Molecular Formula
2 C20 H20 Cl N O4
Molecular Weight
747.66
Product Categories
Impurity Reference Materials , Analgesics, Non-steroidal anti-inflammatory drugs (NSAIDs), Mikromol
Product Type
ImpurityDrug Type
Analgesics
Product Information
Analyte Data
Analyte Name
Benoxaprofen 1,3-Butylene Glycol Esters (Mixture of Regio- and Stereoisomers)
Molecular Formula
2 C20 H20 Cl N O4
Molecular Weight
747.66
Accurate Mass
746.2162
SMILES
CC(O)CCOC(=O)C(C)c1ccc2oc(nc2c1)c3ccc(Cl)cc3.CC(CCO)OC(=O)C(C)c4ccc5oc(nc5c4)c6ccc(Cl)cc6
InChI
InChI=1S/2C20H20ClNO4/c1-12(23)9-10-25-20(24)13(2)15-5-8-18-17(11-15)22-19(26-18)14-3-6-16(21)7-4-14, 1-12(9-10-23)25-20(24)13(2)15-5-8-18-17(11-15)22-19(26-18)14-3-6-16(21)7-4-14/h2*3-8,11-13,23H,9-10H2,1-2H3
IUPAC
4-hydroxybutan-2-yl 2-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]propanoate;3-hydroxybutyl 2-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]propanoate
Product Data
Storage Temperature
+5°C
Shipping Temperature
Room Temperature
Country of Origin
GERMANY
Product Type
Impurity
Product Format
Neat
Impurity Type
Degradation Product
