Ethyl 4-amino-3-bromo-5-nitrobenzoate

Name: Ethyl 4-amino-3-bromo-5-nitrobenzoate
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CAS No. 82760-42-7
Cat. No. CS-0029773
Molecule weight289.08
Purity≥97%
MDL No.MFCD00044014

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Ethyl 4-amino-3-bromo-5-nitrobenzoate|CS-0029773

Structure of 82760-42-7

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General Information

CAS No. 82760-42-7
Cat. No. CS-0029773
Purity ≥97%
MDL No. MFCD00044014
Storage 4°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₉BrN₂O₄
Molecular Weight 289.08
Synonym(s) Benzoic acid, 4-amino-3-bromo-5-nitro-, ethyl ester
SMILES O=C(OCC)C1=CC([N+]([O-])=O)=C(N)C(Br)=C1

Synthesis

Route1
- In-stock
  
  76918-64-4
- ~93%
- In-stock
  
  82760-42-7
References
- GLAXO GROUP LIMITED Patent: WO2004/50619 A1, 2004 ; Location in patent: Page 59 ; WO 2004/050619 A1

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

TPSA 95.46
LogP 2.1162
H_Acceptors 5
H_Donors 1
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Nitro compounds

Building Blocks Functional Group Bromide

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

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Ethyl 4-amino-3-bromo-5-nitrobenzoate

CAS No. 82760-42-7

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