Home Halogens Ethyl 3-bromo-4-chloro-5-nitrobenzoate

Ethyl 3-bromo-4-chloro-5-nitrobenzoate

CAS No.:
1503959-72-5
Catalog Number:
AG00HXSM
Molecular Formula:
C9H7BrClNO4
Molecular Weight:
308.5132
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$438
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Product Description
Catalog Number:
AG00HXSM
Chemical Name:
Ethyl 3-bromo-4-chloro-5-nitrobenzoate
CAS Number:
1503959-72-5
Molecular Formula:
C9H7BrClNO4
Molecular Weight:
308.5132
MDL Number:
MFCD24107137
IUPAC Name:
ethyl 3-bromo-4-chloro-5-nitrobenzoate
InChI:
InChI=1S/C9H7BrClNO4/c1-2-16-9(13)5-3-6(10)8(11)7(4-5)12(14)15/h3-4H,2H2,1H3
InChI Key:
WABNGGIFKDTJIW-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(Br)c(c(c1)[N+](=O)[O-])Cl
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.925g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.512g/mol
Monoisotopic Mass:
306.925g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties