RefChem:567201
ethyl 3-[5-acetamido-4-[(2-bromo-4,6-dinitrophenyl)diazenyl]-N-(2-hydroxyethyl)-2-methoxyanilino]propanoate
Also Known As: EINECS 267-765-2|.beta.-Alanine, N-[5-(acetylamino)-4-[(2-bromo-4,6-dinitrophenyl)azo]-2-methoxyphenyl]-N-(2-hydroxyethyl)-, ethyl ester|3-((5-Acetylamino-4-((2-bromo-4,6-dinitrophenyl)azo)-2-methoxyphenyl)(2-hydroxyethyl)amino)propanoic acid, ethyl ester|beta-Alanine, N-(5-(acetylamino)-4-((2-bromo-4,6-dinitrophenyl)azo)-2-methoxyphenyl)-N-(2-hydroxyethyl)-, ethyl ester|beta-Alanine, N-(5-(acetylamino)-4-(2-(2-bromo-4,6-dinitrophenyl)diazenyl)-2-methoxyphenyl)-N-(2-hydroxyethyl)-, ethyl ester|ETHYL N-[5-(ACETYLAMINO)-4-[(2-BROMO-4,6-DINITROPHENYL)AZO]-2-METHOXYPHENYL]-N-(2-HYDROXYETHYL)-BETA-ALANINATE|ethyl n-{5-(acetylamino)-4-[(e)-(2-bromo-4,6-dinitrophenyl)diazenyl]-2-methoxyphenyl}-n-(2-hydroxyethyl)-|A-alaninate|.beta.-Alanine, N-[5-(acetylamino)-4-[2-(2-bromo-4,6-dinitrophenyl)diazenyl]-2-methoxyphenyl]-N-(2-hydroxyethyl)-, ethyl ester|beta-Alanine, N-[5-(acetylamino)-4-[(2-bromo-4,6-dinitrophenyl)azo]-2-methoxyphenyl]-N-(2-hydroxyethyl)-, ethyl ester|ETHYL 3-({4-[2-(2-BROMO-4,6-DINITROPHENYL)DIAZEN-1-YL]-5-ACETAMIDO-2-METHOXYPHENYL}(2-HYDROXYETHYL)AMINO)PROPANOATE|ethyl 3-[5-acetamido-4-[(2-bromo-4,6-dinitrophenyl)diazenyl]-N-(2-hydroxyethyl)-2-methoxyanilino]propanoate|Ethyl N-(5-(acetylamino)-4-((2-bromo-4,6-dinitrophenyl)azo)-2-methoxyphenyl)-N-(2-hydroxyethyl)-beta-alaninate|Ethyl N-{5-acetamido-4-[(2-bromo-4,6-dinitrophenyl)diazenyl]-2-methoxyphenyl}-N-(2-hydroxyethyl)-beta-alaninate|N-[5-(Acetylamino)-4-[(2-bromo-4,6-dinitrophenyl)azo]-2-methoxyphenyl]-N-(2-hydroxyethyl)-beta-alanine ethyl ester|Propanoic acid, 3-[[5-(acetylamino)-4-[(2-bromo-4,6-dinitrophenyl)azo]-2-methoxyphenyl](2-hydroxyethyl)amino]-, ethyl ester
| Molecular Formula | C22H25BrN6O9 |
|---|---|
| Molecular Weight | 596.0867 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 199.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 13 |
| Exact Mass | 596.0867 |
| Heavy Atoms | 38 |
| Complexity | 1254.3 |
Chemical Identifiers
| CAS Number | 67923-49-3 |
|---|---|
| SMILES | CCOC(=O)CCN(CCO)C1=C(C=C(C(=C1)NC(=O)C)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC |
Product Overview
RefChem:567201 (CAS 67923-49-3), with molecular formula C22H25BrN6O9 and molecular weight 596.0867 g/mol. IUPAC: ethyl 3-[5-acetamido-4-[(2-bromo-4,6-dinitrophenyl)diazenyl]-N-(2-hydroxyethyl)-2-methoxyanilino]propanoate.
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