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Home Nitros 2,3,4-Trifluoro-1-nitrobenzene

2,3,4-Trifluoro-1-nitrobenzene

CAS No.:
771-69-7
Catalog Number:
AG003AZM
Molecular Formula:
C6H2F3NO2
Molecular Weight:
177.0808
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
98%(GC)
In Stock USA
United States
$33
- +
100g
98%
In Stock USA
United States
$38
- +
500g
98%
In Stock USA
United States
$113
- +
Product Description
Catalog Number:
AG003AZM
Chemical Name:
2,3,4-Trifluoro-1-nitrobenzene
CAS Number:
771-69-7
Molecular Formula:
C6H2F3NO2
Molecular Weight:
177.0808
MDL Number:
MFCD00041546
IUPAC Name:
1,2,3-trifluoro-4-nitrobenzene
InChI:
InChI=1S/C6H2F3NO2/c7-3-1-2-4(10(11)12)6(9)5(3)8/h1-2H
InChI Key:
ARCACZWMYGILNI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1F)F)F
EC Number:
212-238-4
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.004g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.082g/mol
Monoisotopic Mass:
177.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Palladium-catalyzed C-F activation of polyfluoronitrobenzene derivatives in Suzuki-Miyaura coupling reactions. The Journal of organic chemistry 20100903
Properties