Home Nitros Ethyl 2,4-difluoro-5-nitrobenzoate

Ethyl 2,4-difluoro-5-nitrobenzoate

CAS No.:
179011-37-1
Catalog Number:
AG0026OK
Molecular Formula:
C9H7F2NO4
Molecular Weight:
231.1530
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$332
- +
1g
95%
1 week
United States
$774
- +
Product Description
Catalog Number:
AG0026OK
Chemical Name:
Ethyl 2,4-difluoro-5-nitrobenzoate
CAS Number:
179011-37-1
Molecular Formula:
C9H7F2NO4
Molecular Weight:
231.1530
MDL Number:
MFCD12172523
IUPAC Name:
ethyl 2,4-difluoro-5-nitrobenzoate
InChI:
InChI=1S/C9H7F2NO4/c1-2-16-9(13)5-3-8(12(14)15)7(11)4-6(5)10/h3-4H,2H2,1H3
InChI Key:
HKGIEPXOWGJFCW-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(C(=O)OCC)c(cc1F)F
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.034g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.155g/mol
Monoisotopic Mass:
231.034g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties