Home Nitros Methyl 2-cyano-2-(4-fluoro-2-nitrophenyl)acetate

Methyl 2-cyano-2-(4-fluoro-2-nitrophenyl)acetate

CAS No.:
1381944-42-8
Catalog Number:
AG001872
Molecular Formula:
C10H7FN2O4
Molecular Weight:
238.1720
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$188
- +
25g
98%
In Stock USA
United States
$450
- +
100g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG001872
Chemical Name:
Methyl 2-cyano-2-(4-fluoro-2-nitrophenyl)acetate
CAS Number:
1381944-42-8
Molecular Formula:
C10H7FN2O4
Molecular Weight:
238.1720
MDL Number:
MFCD22375003
IUPAC Name:
methyl 2-cyano-2-(4-fluoro-2-nitrophenyl)acetate
InChI:
InChI=1S/C10H7FN2O4/c1-17-10(14)8(5-12)7-3-2-6(11)4-9(7)13(15)16/h2-4,8H,1H3
InChI Key:
JXZFDKZJFAHOIK-UHFFFAOYSA-N
SMILES:
N#CC(c1ccc(cc1[N+](=O)[O-])F)C(=O)OC
Properties
Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.039g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.174g/mol
Monoisotopic Mass:
238.039g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties