Home Nitros 4-Fluoro-2-methyl-5-nitrobenzoic acid

4-Fluoro-2-methyl-5-nitrobenzoic acid

CAS No.:
64695-92-7
Catalog Number:
AG00EKP2
Molecular Formula:
C8H6FNO4
Molecular Weight:
199.1359
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$60
- +
5g
98%
In Stock USA
United States
$180
- +
25g
98%
In Stock USA
United States
$540
- +
Product Description
Catalog Number:
AG00EKP2
Chemical Name:
4-Fluoro-2-methyl-5-nitrobenzoic acid
CAS Number:
64695-92-7
Molecular Formula:
C8H6FNO4
Molecular Weight:
199.1359
MDL Number:
MFCD11847453
IUPAC Name:
4-fluoro-2-methyl-5-nitrobenzoic acid
InChI:
InChI=1S/C8H6FNO4/c1-4-2-6(9)7(10(13)14)3-5(4)8(11)12/h2-3H,1H3,(H,11,12)
InChI Key:
IBZJPGGBZMXXCE-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(C(=O)O)c(cc1F)C
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.028g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
199.137g/mol
Monoisotopic Mass:
199.028g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties