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Home > Indoles and Oxindole > 729580-76-1
729580-76-1 | 2-Butanone, 4-phenyl-4-(2-phenyl-1H-indol-3-yl)-
CAS No: 729580-76-1 Catalog No: AG005D19 MDL No:
Product Description
Catalog Number:
AG005D19
Chemical Name:
2-Butanone, 4-phenyl-4-(2-phenyl-1H-indol-3-yl)-
CAS Number:
729580-76-1
Molecular Formula:
C24H21NO
Molecular Weight:
339.4296
IUPAC Name:
4-phenyl-4-(2-phenyl-1H-indol-3-yl)butan-2-one
InChI:
InChI=1S/C24H21NO/c1-17(26)16-21(18-10-4-2-5-11-18)23-20-14-8-9-15-22(20)25-24(23)19-12-6-3-7-13-19/h2-15,21,25H,16H2,1H3
InChI Key:
GACNCPIGRJZYJS-UHFFFAOYSA-N
SMILES:
CC(=O)CC(c1c([nH]c2c1cccc2)c1ccccc1)c1ccccc1
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.162g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
339.438g/mol
Monoisotopic Mass:
339.162g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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