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Home > Indoles and Oxindole > 77435-14-4
77435-14-4 | Ethanone, 1-[2-methyl-1-(phenylmethyl)-1H-indol-3-yl]-
CAS No: 77435-14-4 Catalog No: AG005LLT MDL No:
Product Description
Catalog Number:
AG005LLT
Chemical Name:
Ethanone, 1-[2-methyl-1-(phenylmethyl)-1H-indol-3-yl]-
CAS Number:
77435-14-4
Molecular Formula:
C18H17NO
Molecular Weight:
263.3337
IUPAC Name:
1-(1-benzyl-2-methylindol-3-yl)ethanone
InChI:
InChI=1S/C18H17NO/c1-13-18(14(2)20)16-10-6-7-11-17(16)19(13)12-15-8-4-3-5-9-15/h3-11H,12H2,1-2H3
InChI Key:
NOKRAWJIIOSAHX-UHFFFAOYSA-N
SMILES:
CC(=O)c1c2ccccc2n(c1C)Cc1ccccc1
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.131g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.34g/mol
Monoisotopic Mass:
263.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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