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Home > Indoles and Oxindole > 1586-47-6
1586-47-6 | Quinoline, 2-[2-(1H-indol-3-yl)ethenyl]-
CAS No: 1586-47-6 Catalog No: AG001QC0 MDL No:
Product Description
Catalog Number:
AG001QC0
Chemical Name:
Quinoline, 2-[2-(1H-indol-3-yl)ethenyl]-
CAS Number:
1586-47-6
Molecular Formula:
C19H14N2
Molecular Weight:
270.3279
IUPAC Name:
2-[(E)-2-(1H-indol-3-yl)ethenyl]quinoline
InChI:
InChI=1S/C19H14N2/c1-3-7-18-14(5-1)9-11-16(21-18)12-10-15-13-20-19-8-4-2-6-17(15)19/h1-13,20H/b12-10+
InChI Key:
XBSNGDJJHAYDLC-ZRDIBKRKSA-N
SMILES:
c1ccc2c(c1)nc(cc2)C=Cc1c[nH]c2c1cccc2
NSC Number:
76750
Properties
Complexity:
378
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
270.116g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.335g/mol
Monoisotopic Mass:
270.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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