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141306-08-3 | 1H-Indole, 5-chloro-3-(4-fluorophenyl)-
CAS No: 141306-08-3 Catalog No: AG001G75 MDL No:
Product Description
Catalog Number:
AG001G75
Chemical Name:
1H-Indole, 5-chloro-3-(4-fluorophenyl)-
CAS Number:
141306-08-3
Molecular Formula:
C14H9ClFN
Molecular Weight:
245.6794
IUPAC Name:
5-chloro-3-(4-fluorophenyl)-1H-indole
InChI:
InChI=1S/C14H9ClFN/c15-10-3-6-14-12(7-10)13(8-17-14)9-1-4-11(16)5-2-9/h1-8,17H
InChI Key:
XRTGRVRPFBPACT-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1c[nH]c2c1cc(Cl)cc2
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.041g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.681g/mol
Monoisotopic Mass:
245.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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