((6-Bromo-2-benzothiazolyl)amino)oxoacetic acid ethyl ester

ethyl 2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoacetate

CAS: 84761-95-5

Molecular Formula	`C11H9BrN2O3S`
Molecular Weight	329.17 g/mol
LogP	3.2
Topological Polar Surface Area	96.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	327.95172
Heavy Atoms	18
Complexity	342.0

Chemical Identifiers

CAS Number	84761-95-5
SMILES	`CCOC(=O)C(=O)NC1=NC2=C(S1)C=C(C=C2)Br`
InChIKey	`GMQRCZGPJFAZIB-UHFFFAOYSA-N`

📖 Product Overview

((6-Bromo-2-benzothiazolyl)amino)oxoacetic acid ethyl ester (CAS: 84761-95-5) is a chemical compound with molecular formula C11H9BrN2O3S and molecular weight 329.17 g/mol. Its IUPAC systematic name is ethyl 2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoacetate. LogP 3.2 Topological Polar Surface Area 96.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 327.95172 Heavy Atoms 18 Complexity 342.0 InChI Key: GMQRCZGPJFAZIB-UHFFFAOYSA-N. SMILES: CCOC(=O)C(=O)NC1=NC2=C(S1)C=C(C=C2)Br.

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