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24620-45-9 | 1H-Indole, 3-(2-phenylethenyl)-
CAS No: 24620-45-9 Catalog No: AG002OSX MDL No:
Product Description
Catalog Number:
AG002OSX
Chemical Name:
1H-Indole, 3-(2-phenylethenyl)-
CAS Number:
24620-45-9
Molecular Formula:
C16H13N
Molecular Weight:
219.2811
IUPAC Name:
3-(2-phenylethenyl)-1H-indole
InChI:
InChI=1S/C16H13N/c1-2-6-13(7-3-1)10-11-14-12-17-16-9-5-4-8-15(14)16/h1-12,17H
InChI Key:
DZMBGFYPZAPYOI-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C=Cc1c[nH]c2c1cccc2
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.105g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.287g/mol
Monoisotopic Mass:
219.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
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