ACETIC ACID, ((6-BROMO-2-BENZOTHIAZOLYL)AMINO)OXO-, METHYL ESTER
methyl 2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoacetate
| Molecular Formula | C10H7BrN2O3S |
|---|---|
| Molecular Weight | 315.15 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 96.5 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.93607 |
| Heavy Atoms | 17 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 104388-86-5 |
|---|---|
| SMILES | COC(=O)C(=O)NC1=NC2=C(S1)C=C(C=C2)Br |
| InChIKey | LOOZHJWSYCQZEQ-UHFFFAOYSA-N |
📖 Product Overview
ACETIC ACID, ((6-BROMO-2-BENZOTHIAZOLYL)AMINO)OXO-, METHYL ESTER (CAS: 104388-86-5) is a chemical compound with molecular formula C10H7BrN2O3S and molecular weight 315.15 g/mol. Its IUPAC systematic name is methyl 2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoacetate.
LOOZHJWSYCQZEQ-UHFFFAOYSA-N.
SMILES: COC(=O)C(=O)NC1=NC2=C(S1)C=C(C=C2)Br.
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