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Home Nitros 4,4'-Dinitro-3,3'-bis(trifluoromethyl)biphenyl

4,4'-Dinitro-3,3'-bis(trifluoromethyl)biphenyl

CAS No.:
363-95-1
Catalog Number:
AG003KG8
Molecular Formula:
C14H6F6N2O4
Molecular Weight:
380.1989
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
98%
In Stock USA
United States
$79
- +
250mg
98%
In Stock USA
United States
$157
- +
1g
98%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG003KG8
Chemical Name:
4,4'-Dinitro-3,3'-bis(trifluoromethyl)biphenyl
CAS Number:
363-95-1
Molecular Formula:
C14H6F6N2O4
Molecular Weight:
380.1989
MDL Number:
MFCD08282786
IUPAC Name:
1-nitro-4-[4-nitro-3-(trifluoromethyl)phenyl]-2-(trifluoromethyl)benzene
InChI:
InChI=1S/C14H6F6N2O4/c15-13(16,17)9-5-7(1-3-11(9)21(23)24)8-2-4-12(22(25)26)10(6-8)14(18,19)20/h1-6H
InChI Key:
XTBWIABPTZDUPM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1C(F)(F)F)c1ccc(c(c1)C(F)(F)F)[N+](=O)[O-]
Properties
Complexity:
494  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
380.023g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
380.202g/mol
Monoisotopic Mass:
380.023g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Properties