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Home > Fluorides > 154344-00-0
154344-00-0 | 2',3',4',5',6'-Pentafluoro[1,1'-biphenyl]-4-carbonitrile
CAS No: 154344-00-0 Catalog No: AG01F7K6 MDL No:
Product Description
Catalog Number:
AG01F7K6
Chemical Name:
2',3',4',5',6'-Pentafluoro[1,1'-biphenyl]-4-carbonitrile
CAS Number:
154344-00-0
Molecular Formula:
C13H4F5N
Molecular Weight:
269.1696
IUPAC Name:
4-(2,3,4,5,6-pentafluorophenyl)benzonitrile
InChI:
InChI=1S/C13H4F5N/c14-9-8(7-3-1-6(5-19)2-4-7)10(15)12(17)13(18)11(9)16/h1-4H
InChI Key:
LHUKISKVNWDUAO-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)c1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.026g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.174g/mol
Monoisotopic Mass:
269.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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