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Home > Fluorides > 116993-61-4
116993-61-4 | 1H-Indole, 2-(2,3,4,5,6-pentafluorophenyl)-
CAS No: 116993-61-4 Catalog No: AG000DH1 MDL No:
Product Description
Catalog Number:
AG000DH1
Chemical Name:
1H-Indole, 2-(2,3,4,5,6-pentafluorophenyl)-
CAS Number:
116993-61-4
Molecular Formula:
C14H6F5N
Molecular Weight:
283.1962
IUPAC Name:
2-(2,3,4,5,6-pentafluorophenyl)-1H-indole
InChI:
InChI=1S/C14H6F5N/c15-10-9(11(16)13(18)14(19)12(10)17)8-5-6-3-1-2-4-7(6)20-8/h1-5,20H
InChI Key:
WPYTYTWOOGJTRZ-UHFFFAOYSA-N
SMILES:
Fc1c(F)c(F)c(c(c1F)F)c1cc2c([nH]1)cccc2
Properties
Complexity:
339
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:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.201g/mol
Monoisotopic Mass:
283.042g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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