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Home > Indoles and Oxindole > 796964-13-1
796964-13-1 | 1H-Indole,1-methyl-2-phenyl-3-propyl-
CAS No: 796964-13-1 Catalog No: AG0050WF MDL No:
Product Description
Catalog Number:
AG0050WF
Chemical Name:
1H-Indole,1-methyl-2-phenyl-3-propyl-
CAS Number:
796964-13-1
Molecular Formula:
C18H19N
Molecular Weight:
249.3502
IUPAC Name:
1-methyl-2-phenyl-3-propylindole
InChI:
InChI=1S/C18H19N/c1-3-9-16-15-12-7-8-13-17(15)19(2)18(16)14-10-5-4-6-11-14/h4-8,10-13H,3,9H2,1-2H3
InChI Key:
PPQAGRXNKROYIP-UHFFFAOYSA-N
SMILES:
CCCc1c(c2ccccc2)n(c2c1cccc2)C
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.152g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.357g/mol
Monoisotopic Mass:
249.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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