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

Ethyl 4,5-difluoro-2-nitrobenzoate

CAS No.:
1214387-06-0
Catalog Number:
AG0014ZB
Molecular Formula:
C9H7F2NO4
Molecular Weight:
231.1530
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥95%
In Stock USA
United States
$69
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Product Description
Catalog Number:
AG0014ZB
Chemical Name:
Ethyl 4,5-difluoro-2-nitrobenzoate
CAS Number:
1214387-06-0
Molecular Formula:
C9H7F2NO4
Molecular Weight:
231.1530
MDL Number:
MFCD11042826
IUPAC Name:
ethyl 4,5-difluoro-2-nitrobenzoate
InChI:
InChI=1S/C9H7F2NO4/c1-2-16-9(13)5-3-6(10)7(11)4-8(5)12(14)15/h3-4H,2H2,1H3
InChI Key:
CWBDZGOBRZAYMQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(F)c(cc1C(=O)OCC)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