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246230-86-4 | Benzofuran, 3-iodo-2-phenyl-
CAS No: 246230-86-4 Catalog No: AG002OTE MDL No:
Product Description
Catalog Number:
AG002OTE
Chemical Name:
Benzofuran, 3-iodo-2-phenyl-
CAS Number:
246230-86-4
Molecular Formula:
C14H9IO
Molecular Weight:
320.1251
IUPAC Name:
3-iodo-2-phenyl-1-benzofuran
InChI:
InChI=1S/C14H9IO/c15-13-11-8-4-5-9-12(11)16-14(13)10-6-2-1-3-7-10/h1-9H
InChI Key:
RYBYQJBZNPJMBB-UHFFFAOYSA-N
SMILES:
Ic1c(oc2c1cccc2)c1ccccc1
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.97g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
320.129g/mol
Monoisotopic Mass:
319.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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