Home Nitros Methyl 4-cyano-2-fluoro-5-nitrobenzoate

Methyl 4-cyano-2-fluoro-5-nitrobenzoate

CAS No.:
1149388-51-1
Catalog Number:
AG000FGX
Molecular Formula:
C9H5FN2O4
Molecular Weight:
224.1454
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$119
- +
1g
95%
In Stock USA
United States
$294
- +
5g
95%
In Stock USA
United States
$1032
- +
Product Description
Catalog Number:
AG000FGX
Chemical Name:
Methyl 4-cyano-2-fluoro-5-nitrobenzoate
CAS Number:
1149388-51-1
Molecular Formula:
C9H5FN2O4
Molecular Weight:
224.1454
MDL Number:
MFCD26390065
IUPAC Name:
methyl 4-cyano-2-fluoro-5-nitrobenzoate
InChI:
InChI=1S/C9H5FN2O4/c1-16-9(13)6-3-8(12(14)15)5(4-11)2-7(6)10/h2-3H,1H3
InChI Key:
BWXKIOJKNHOIID-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc([N+](=O)[O-])c(cc1F)C#N
Properties
Complexity:
345  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.023g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.147g/mol
Monoisotopic Mass:
224.023g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties