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Home > Indoles and Oxindole > 849071-27-8
849071-27-8 | 1H-Indole, 1,2,3,5,7-pentaphenyl-
CAS No: 849071-27-8 Catalog No: AG004LZW MDL No:
Product Description
Catalog Number:
AG004LZW
Chemical Name:
1H-Indole, 1,2,3,5,7-pentaphenyl-
CAS Number:
849071-27-8
Molecular Formula:
C38H27N
Molecular Weight:
497.6277
IUPAC Name:
1,2,3,5,7-pentakis-phenylindole
InChI:
InChI=1S/C38H27N/c1-6-16-28(17-7-1)32-26-34(29-18-8-2-9-19-29)38-35(27-32)36(30-20-10-3-11-21-30)37(31-22-12-4-13-23-31)39(38)33-24-14-5-15-25-33/h1-27H
InChI Key:
KLMZWEWDJBHSSM-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1cc(c2ccccc2)c2c(c1)c(c1ccccc1)c(n2c1ccccc1)c1ccccc1
Properties
Complexity:
730
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
497.214g/mol
Formal Charge:
0
Heavy Atom Count:
39
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
497.641g/mol
Monoisotopic Mass:
497.214g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.2
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