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Home > Indoles and Oxindole > 89188-99-8
89188-99-8 | 1H-Indole, 3-ethyl-2-(phenylmethyl)-
CAS No: 89188-99-8 Catalog No: AG003VZR MDL No:
Product Description
Catalog Number:
AG003VZR
Chemical Name:
1H-Indole, 3-ethyl-2-(phenylmethyl)-
CAS Number:
89188-99-8
Molecular Formula:
C17H17N
Molecular Weight:
235.3236
IUPAC Name:
2-benzyl-3-ethyl-1H-indole
InChI:
InChI=1S/C17H17N/c1-2-14-15-10-6-7-11-16(15)18-17(14)12-13-8-4-3-5-9-13/h3-11,18H,2,12H2,1H3
InChI Key:
WTSIDWWGDLJUHR-UHFFFAOYSA-N
SMILES:
CCc1c(Cc2ccccc2)[nH]c2c1cccc2
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.136g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.33g/mol
Monoisotopic Mass:
235.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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