CAS 16096-33-6 | 1H-Indole, 1-phenyl- | CAS Number 16096-33-6

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16096-33-6 | 1H-Indole, 1-phenyl-

CAS No: 16096-33-6 Catalog No: AG001VK3 MDL No:MFCD00123280

Product Description

Catalog Number:

AG001VK3

Chemical Name:

1H-Indole, 1-phenyl-

CAS Number:

16096-33-6

Molecular Formula:

C14H11N

Molecular Weight:

193.2438

MDL Number:

MFCD00123280

IUPAC Name:

1-phenylindole

InChI:

InChI=1S/C14H11N/c1-2-7-13(8-3-1)15-11-10-12-6-4-5-9-14(12)15/h1-11H

InChI Key:

YBFCBQMICVOSRW-UHFFFAOYSA-N

SMILES:

c1ccc(cc1)n1ccc2c1cccc2

Properties

Complexity:

207

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

193.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

193.249g/mol

Monoisotopic Mass:

193.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

4.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.4

Literature

Title	Journal
Highly enantioselective trapping of zwitterionic intermediates by imines.	Nature chemistry 20120901
Ruthenium-catalyzed alkylation of indoles with tertiary amines by oxidation of a sp3 C-H bond and Lewis acid catalysis.	Chemistry (Weinheim an der Bergstrasse, Germany) 20100517
Thermal ring contraction of dibenz[b,f]azepin-5-yl radicals: new routes to pyrrolo[3,2,1-jk]carbazoles.	The Journal of organic chemistry 20080905