Home Nitros Methyl 2-cyano-2-(2,3-difluoro-6-nitrophenyl)acetate

Methyl 2-cyano-2-(2,3-difluoro-6-nitrophenyl)acetate

CAS No.:
2055119-07-6
Catalog Number:
AG00I3WI
Molecular Formula:
C10H6F2N2O4
Molecular Weight:
256.1624
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG00I3WI
Chemical Name:
Methyl 2-cyano-2-(2,3-difluoro-6-nitrophenyl)acetate
CAS Number:
2055119-07-6
Molecular Formula:
C10H6F2N2O4
Molecular Weight:
256.1624
MDL Number:
MFCD06802316
IUPAC Name:
methyl 2-cyano-2-(2,3-difluoro-6-nitrophenyl)acetate
InChI:
InChI=1S/C10H6F2N2O4/c1-18-10(15)5(4-13)8-7(14(16)17)3-2-6(11)9(8)12/h2-3,5H,1H3
InChI Key:
ITFLRTXKXIZFFA-UHFFFAOYSA-N
SMILES:
N#CC(c1c(ccc(c1F)F)[N+](=O)[O-])C(=O)OC
Properties
Complexity:
389  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.03g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.165g/mol
Monoisotopic Mass:
256.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties