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Home > Products > Pharmaceutical R&D Materials > Heterocyclic Building Blocks > 5-[Bis(2-chloroethyl)aMino]-1-Methyl-1H-benziMidazole-2-butanoic Acid Methyl Ester
5-[Bis(2-chloroethyl)aMino]-1-Methyl-1H-benziMidazole-2-butanoic Acid Methyl Ester structure, CAS 109882-25-9

5-[Bis(2-chloroethyl)aMino]-1-Methyl-1H-benziMidazole-2-butanoic Acid Methyl Ester

CAS Number109882-25-9

SynonymsMethylhydroxy-Celecoxib; PRIMARY ALCOHOL METABOLITE OF CELECOXIB; bendamustine methyl ester; 4'-Hydroxycelecoxib; Hydroxy Celecoxib; Celecoxib metabolite M3

Molecular FormulaC16H21O2N3Cl2

Molecular Weight358.27

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Cat. No.: 2A-3179480 Purity:
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Chemical & Physical Properties
CAS Number109882-25-9
Catalog No.2A-3179480
Chinese Name5-[双(2-氯乙基)氨基]-1-甲基-1H-苯并咪唑-2-丁酸甲基酯
SynonymsMethylhydroxy-Celecoxib; PRIMARY ALCOHOL METABOLITE OF CELECOXIB; bendamustine methyl ester; 4'-Hydroxycelecoxib; Hydroxy Celecoxib; Celecoxib metabolite M3
Molecular FormulaC16H21O2N3Cl2
Molecular Weight358.27
PubChem ID92761731
MDL NumberMFCD00866481
SMILESCOC(=O)CCCc1nc2cc(N(CCCl)CCCl)ccc2n1C
InChIInChI=1S/C17H23Cl2N3O2/c1-21-15-7-6-13(22(10-8-18)11-9-19)12-14(15)20-16(21)4-3-5-17(23)24-2/h6-7,12H,3-5,8-11H2,1-2H3
InChI KeyCFNXGULFAQAFAB-UHFFFAOYSA-N
Transport InfoProduct name: 5-[Bis(2-chloroethyl)amino]-1-methyl-1H-benzimidazole-2-butyric acid methyl ester
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