Home Nitros Methyl 4-fluoro-3-nitrobenzoate

Methyl 4-fluoro-3-nitrobenzoate

CAS No.:
329-59-9
Catalog Number:
AG003RV9
Molecular Formula:
C8H6FNO4
Molecular Weight:
199.1359
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$44
- +
100g
98%
In Stock USA
United States
$125
- +
500g
98%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG003RV9
Chemical Name:
Methyl 4-fluoro-3-nitrobenzoate
CAS Number:
329-59-9
Molecular Formula:
C8H6FNO4
Molecular Weight:
199.1359
MDL Number:
MFCD00196161
IUPAC Name:
methyl 4-fluoro-3-nitrobenzoate
InChI:
InChI=1S/C8H6FNO4/c1-14-8(11)5-2-3-6(9)7(4-5)10(12)13/h2-4H,1H3
InChI Key:
CNJJSTPBUHAEFH-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)[N+](=O)[O-])F
Properties
Complexity:
240  
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:
0
Isotope Atom Count:
0
Molecular Weight:
199.137g/mol
Monoisotopic Mass:
199.028g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties