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Home > Indoles and Oxindole > 78842-63-4
78842-63-4 | 1H-Indole, 2-(2-benzofuranyl)-
CAS No: 78842-63-4 Catalog No: AG005D87 MDL No:
Product Description
Catalog Number:
AG005D87
Chemical Name:
1H-Indole, 2-(2-benzofuranyl)-
CAS Number:
78842-63-4
Molecular Formula:
C16H11NO
Molecular Weight:
233.2646
IUPAC Name:
2-(1-benzofuran-2-yl)-1H-indole
InChI:
InChI=1S/C16H11NO/c1-3-7-13-11(5-1)9-14(17-13)16-10-12-6-2-4-8-15(12)18-16/h1-10,17H
InChI Key:
ZIMOURYOOIPWBS-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)cc(o2)c1[nH]c2c(c1)cccc2
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.084g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.27g/mol
Monoisotopic Mass:
233.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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