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157017-41-9 | 1H-Pyrrole, 1-(2-iodophenyl)-
CAS No: 157017-41-9 Catalog No: AG001P57 MDL No:MFCD02665232
Product Description
Catalog Number:
AG001P57
Chemical Name:
1H-Pyrrole, 1-(2-iodophenyl)-
CAS Number:
157017-41-9
Molecular Formula:
C10H8IN
Molecular Weight:
269.0817
MDL Number:
MFCD02665232
IUPAC Name:
1-(2-iodophenyl)pyrrole
InChI:
InChI=1S/C10H8IN/c11-9-5-1-2-6-10(9)12-7-3-4-8-12/h1-8H
InChI Key:
ARMKFWKBOLWXEF-UHFFFAOYSA-N
SMILES:
Ic1ccccc1n1cccc1
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.97g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.085g/mol
Monoisotopic Mass:
268.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Mechanistic studies of Pd-catalyzed regioselective aryl C-H bond functionalization with strained alkenes: origin of regioselectivity. | Chemistry (Weinheim an der Bergstrasse, Germany) 20110711 |
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