Methyl N-[5-(acetylamino)-4-[(2-bromo-4,6-dinitrophenyl)azo]-2-ethoxyphenyl]beta-alaninate

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Catalog Number
ACM94108948
Product Name
Methyl N-[5-(acetylamino)-4-[(2-bromo-4,6-dinitrophenyl)azo]-2-ethoxyphenyl]beta-alaninate
Structure
Structure
CAS
94108-94-8
Category
Heterocyclic Organic Compound
Synonyms
EINECS 302-431-2, Methyl N-(5-(acetylamino)-4-((2-bromo-4,6-dinitrophenyl)azo)-2-ethoxyphenyl)beta-alaninate, 94108-94-8
IUPAC Name
methyl 3-[5-acetamido-4-[(2-bromo-4,6-dinitrophenyl)diazenyl]-2-ethoxyanilino]propanoate
Molecular Weight
553.320140 [g/mol]
Molecular Formula
C20H21BrN6O8
Canonical SMILES
CCOC1=C(C=C(C(=C1)N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C)NCCC(=O)OC
InChI Key
PBUMZYFAPJBJMW-UHFFFAOYSA-N
Boiling Point
766.1ºC at 760mmHg
Flash Point
417.1ºC
Density
1.6g/cm³
EC Number
302-431-2
Exact Mass
552.06000
H-Bond Acceptor
11
H-Bond Donor
2
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