1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-3-hydroxy-1,3-dihydroisobenzofuran-5-carbonitrile Oxalate
Product Code
MM0242.21-0025
CAS Number
EP Description
Citalopram Hydrobromide Impurity B as Oxalate, Escitalopram Oxalate Impurity B as Oxalate
USP Description
Citalopram Related Compound B as Oxalate
Product Format
Neat
Molecular Formula
C20 H21 F N2 O2 . C2 H2 O4
Molecular Weight
430.43
Product Categories
Impurity Reference Materials , Antidepressants, Serotonin, Mikromol
Product Type
ImpurityDrug Type
Antidepressants
Documentation
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Product Information
Analyte Data
Analyte Name
1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-3-hydroxy-1,3-dihydroisobenzofuran-5-carbonitrile Oxalate
CAS Number
1332724-03-4
Molecular Formula
C20 H21 F N2 O2 . C2 H2 O4
Molecular Weight
430.43
Accurate Mass
430.154
SMILES
CN(C)CCCC1(OC(O)c2cc(ccc12)C#N)c3ccc(F)cc3.OC(=O)C(=O)O
InChI
3-1(4)2(5)6/h4-9,12,19,24H,3,10-11H2,1-2H3, (H,3,4)(H,5,6), InChI=1S/C20H21FN2O2.C2H2O4/c1-23(2)11-3-10-20(15-5-7-16(21)8-6-15)18-9-4-14(13-22)12-17(18)19(24)25-20
IUPAC
1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3-hydroxy-3H-2-benzofuran-5-carbonitrile;oxalic acid
Product Data
Storage Temperature
+5°C
Shipping Temperature
Room Temperature
Country of Origin
GERMANY
Product Type
Impurity
Product Format
Neat
Impurity Type
Intermediate; By-Product
API Family
