Home Other Building Blocks 1H-Indole, 4,5,6,7-tetrafluoro-

1H-Indole, 4,5,6,7-tetrafluoro-

CAS No.:
16264-67-8
Catalog Number:
AG001TAE
Molecular Formula:
C8H3F4N
Molecular Weight:
189.1097
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Product Description
Catalog Number:
AG001TAE
Chemical Name:
1H-Indole, 4,5,6,7-tetrafluoro-
CAS Number:
16264-67-8
Molecular Formula:
C8H3F4N
Molecular Weight:
189.1097
MDL Number:
MFCD00236717
IUPAC Name:
4,5,6,7-tetrafluoro-1H-indole
InChI:
InChI=1S/C8H3F4N/c9-4-3-1-2-13-8(3)7(12)6(11)5(4)10/h1-2,13H
InChI Key:
DTNBMVQXEVNTLO-UHFFFAOYSA-N
SMILES:
Fc1c(F)c(F)c2c(c1F)[nH]cc2
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.02g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.113g/mol
Monoisotopic Mass:
189.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Fluorous base-pairing effects in a DNA polymerase active site. Chemistry (Weinheim an der Bergstrasse, Germany) 20050506
Selective pairing of polyfluorinated DNA bases. Journal of the American Chemical Society 20040317
Properties