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16264-67-8 | 1H-Indole, 4,5,6,7-tetrafluoro-
CAS No: 16264-67-8 Catalog No: AG001TAE MDL No:MFCD00236717
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 |
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