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Home > Indoles and Oxindole > 885273-41-6
885273-41-6 | 1H-Indole,6-benzo[b]thien-2-yl-
CAS No: 885273-41-6 Catalog No: AG0046X3 MDL No:MFCD04114749
Product Description
Catalog Number:
AG0046X3
Chemical Name:
1H-Indole,6-benzo[b]thien-2-yl-
CAS Number:
885273-41-6
Molecular Formula:
C16H11NS
Molecular Weight:
249.3302
MDL Number:
MFCD04114749
IUPAC Name:
6-(1-benzothiophen-2-yl)-1H-indole
InChI:
InChI=1S/C16H11NS/c1-2-4-15-12(3-1)10-16(18-15)13-6-5-11-7-8-17-14(11)9-13/h1-10,17H
InChI Key:
RAXZRLLHTSSBKZ-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)sc(c2)c1ccc2c(c1)[nH]cc2
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.061g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.331g/mol
Monoisotopic Mass:
249.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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