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113443-20-2 | 1,1'-Biphenyl, nonafluoro- (9CI)
CAS No: 113443-20-2 Catalog No: AG0008LB MDL No:
Product Description
Catalog Number:
AG0008LB
Chemical Name:
1,1'-Biphenyl, nonafluoro- (9CI)
CAS Number:
113443-20-2
Molecular Formula:
C12HF9
Molecular Weight:
316.1220
IUPAC Name:
1,2,3,4,5-pentafluoro-6-(2,3,4,5-tetrafluorophenyl)benzene
InChI:
InChI=1S/C12HF9/c13-3-1-2(5(14)9(18)6(3)15)4-7(16)10(19)12(21)11(20)8(4)17/h1H
InChI Key:
AXEKTXJVBZVCDC-UHFFFAOYSA-N
SMILES:
Fc1cc(c(c(c1F)F)F)c1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.993g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
316.126g/mol
Monoisotopic Mass:
315.993g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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