Home Halogens Methyl 5-bromo-2-fluoro-3-nitrobenzoate

Methyl 5-bromo-2-fluoro-3-nitrobenzoate

CAS No.:
1154278-17-7
Catalog Number:
AG000FZJ
Molecular Formula:
C8H5BrFNO4
Molecular Weight:
278.0320
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG000FZJ
Chemical Name:
Methyl 5-bromo-2-fluoro-3-nitrobenzoate
CAS Number:
1154278-17-7
Molecular Formula:
C8H5BrFNO4
Molecular Weight:
278.0320
MDL Number:
MFCD12172992
IUPAC Name:
methyl 5-bromo-2-fluoro-3-nitrobenzoate
InChI:
InChI=1S/C8H5BrFNO4/c1-15-8(12)5-2-4(9)3-6(7(5)10)11(13)14/h2-3H,1H3
InChI Key:
ODDWYOBMSSXDDU-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Br)cc(c1F)[N+](=O)[O-]
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.939g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.033g/mol
Monoisotopic Mass:
276.939g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties