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785815-30-7 | 1H-Indole, 3-butyl-2-(4-methylphenyl)-
CAS No: 785815-30-7 Catalog No: AG0059GO MDL No:
Product Description
Catalog Number:
AG0059GO
Chemical Name:
1H-Indole, 3-butyl-2-(4-methylphenyl)-
CAS Number:
785815-30-7
Molecular Formula:
C19H21N
Molecular Weight:
263.3767
IUPAC Name:
3-butyl-2-(4-methylphenyl)-1H-indole
InChI:
InChI=1S/C19H21N/c1-3-4-7-17-16-8-5-6-9-18(16)20-19(17)15-12-10-14(2)11-13-15/h5-6,8-13,20H,3-4,7H2,1-2H3
InChI Key:
RLQPFWOKKJQHGQ-UHFFFAOYSA-N
SMILES:
CCCCc1c([nH]c2c1cccc2)c1ccc(cc1)C
Properties
Complexity:
292
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:
1
Isotope Atom Count:
0
Molecular Weight:
263.384g/mol
Monoisotopic Mass:
263.167g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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