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Home > Indoles and Oxindole > 121565-56-8
121565-56-8 | 1H-Indole, 1-methyl-2-phenyl-3-(2-propen-1-yl)-
CAS No: 121565-56-8 Catalog No: AG0015AB MDL No:
Product Description
Catalog Number:
AG0015AB
Chemical Name:
1H-Indole, 1-methyl-2-phenyl-3-(2-propen-1-yl)-
CAS Number:
121565-56-8
Molecular Formula:
C18H17N
Molecular Weight:
247.3343
IUPAC Name:
1-methyl-2-phenyl-3-prop-2-enylindole
InChI:
InChI=1S/C18H17N/c1-3-9-16-15-12-7-8-13-17(15)19(2)18(16)14-10-5-4-6-11-14/h3-8,10-13H,1,9H2,2H3
InChI Key:
PJMZRJFRZNYNQO-UHFFFAOYSA-N
SMILES:
C=CCc1c(c2ccccc2)n(c2c1cccc2)C
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.136g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.341g/mol
Monoisotopic Mass:
247.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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