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1240113-40-9 | 1H-Indole, 4-fluoro-5-iodo-
CAS No: 1240113-40-9 Catalog No: AG000LED MDL No:
Product Description
Catalog Number:
AG000LED
Chemical Name:
1H-Indole, 4-fluoro-5-iodo-
CAS Number:
1240113-40-9
Molecular Formula:
C8H5FIN
Molecular Weight:
261.0349
IUPAC Name:
4-fluoro-5-iodo-1H-indole
InChI:
InChI=1S/C8H5FIN/c9-8-5-3-4-11-7(5)2-1-6(8)10/h1-4,11H
InChI Key:
CBYZOJLRQMRDKN-UHFFFAOYSA-N
SMILES:
Ic1ccc2c(c1F)cc[nH]2
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.945g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.038g/mol
Monoisotopic Mass:
260.945g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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