Home Halogens Ethyl 2-(5-bromo-3-nitropyridin-2-yl)acetate

Ethyl 2-(5-bromo-3-nitropyridin-2-yl)acetate

CAS No.:
1211540-74-7
Catalog Number:
AG009XDS
Molecular Formula:
C9H9BrN2O4
Molecular Weight:
289.0828
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Product Description
Catalog Number:
AG009XDS
Chemical Name:
Ethyl 2-(5-bromo-3-nitropyridin-2-yl)acetate
CAS Number:
1211540-74-7
Molecular Formula:
C9H9BrN2O4
Molecular Weight:
289.0828
MDL Number:
MFCD16876027
IUPAC Name:
ethyl 2-(5-bromo-3-nitropyridin-2-yl)acetate
InChI:
InChI=1S/C9H9BrN2O4/c1-2-16-9(13)4-7-8(12(14)15)3-6(10)5-11-7/h3,5H,2,4H2,1H3
InChI Key:
ZHLUABBQKYUDCW-UHFFFAOYSA-N
SMILES:
CCOC(=O)Cc1ncc(cc1[N+](=O)[O-])Br
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.975g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.085g/mol
Monoisotopic Mass:
287.975g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties