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Home > Indoles and Oxindole > 844819-43-8
844819-43-8 | 1H-Indole, 2-(1,1-dimethylethyl)-1-(phenylmethyl)-
CAS No: 844819-43-8 Catalog No: AG005508 MDL No:
Product Description
Catalog Number:
AG005508
Chemical Name:
1H-Indole, 2-(1,1-dimethylethyl)-1-(phenylmethyl)-
CAS Number:
844819-43-8
Molecular Formula:
C19H21N
Molecular Weight:
263.3767
IUPAC Name:
1-benzyl-2-tert-butylindole
InChI:
InChI=1S/C19H21N/c1-19(2,3)18-13-16-11-7-8-12-17(16)20(18)14-15-9-5-4-6-10-15/h4-13H,14H2,1-3H3
InChI Key:
NAAVZGUOGQWJQL-UHFFFAOYSA-N
SMILES:
CC(c1cc2c(n1Cc1ccccc1)cccc2)(C)C
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.167g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.384g/mol
Monoisotopic Mass:
263.167g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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