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Home > Fluorides > 893737-93-4
893737-93-4 | (2',3',4',5',6'-Pentafluoro-biphenyl-4-yl)-acetonitrile
CAS No: 893737-93-4 Catalog No: AG01EYOM MDL No:
Product Description
Catalog Number:
AG01EYOM
Chemical Name:
(2',3',4',5',6'-Pentafluoro-biphenyl-4-yl)-acetonitrile
CAS Number:
893737-93-4
Molecular Formula:
C14H6F5N
Molecular Weight:
283.1962
IUPAC Name:
2-[4-(2,3,4,5,6-pentafluorophenyl)phenyl]acetonitrile
InChI:
InChI=1S/C14H6F5N/c15-10-9(11(16)13(18)14(19)12(10)17)8-3-1-7(2-4-8)5-6-20/h1-4H,5H2
InChI Key:
PRAPOKWNEPFWHW-UHFFFAOYSA-N
SMILES:
N#CCc1ccc(cc1)c1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.042g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.201g/mol
Monoisotopic Mass:
283.042g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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