Home Halogens Methyl 2-bromo-4-fluoro-5-nitrobenzoate

Methyl 2-bromo-4-fluoro-5-nitrobenzoate

CAS No.:
85953-31-7
Catalog Number:
AG00GWUF
Molecular Formula:
C8H5BrFNO4
Molecular Weight:
278.0320
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$244
- +
5g
98%
In Stock USA
United States
$869
- +
10g
98%
In Stock USA
United States
$1238
- +
25g
98%
In Stock USA
United States
$2250
- +
Product Description
Catalog Number:
AG00GWUF
Chemical Name:
Methyl 2-bromo-4-fluoro-5-nitrobenzoate
CAS Number:
85953-31-7
Molecular Formula:
C8H5BrFNO4
Molecular Weight:
278.0320
MDL Number:
MFCD12172996
IUPAC Name:
methyl 2-bromo-4-fluoro-5-nitrobenzoate
InChI:
InChI=1S/C8H5BrFNO4/c1-15-8(12)4-2-7(11(13)14)6(10)3-5(4)9/h2-3H,1H3
InChI Key:
UYTRUAPOXQRIMA-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc([N+](=O)[O-])c(cc1Br)F
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