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Home > Indoles and Oxindole > 804551-32-4
804551-32-4 | 1H-Indole, 1,1'-[1,1'-biphenyl]-4,4'-diylbis[2-(2-naphthalenyl)-
CAS No: 804551-32-4 Catalog No: AG005LCN MDL No:
Product Description
Catalog Number:
AG005LCN
Chemical Name:
1H-Indole, 1,1'-[1,1'-biphenyl]-4,4'-diylbis[2-(2-naphthalenyl)-
CAS Number:
804551-32-4
Molecular Formula:
C48H32N2
Molecular Weight:
636.7811
IUPAC Name:
2-naphthalen-2-yl-1-[4-[4-(2-naphthalen-2-ylindol-1-yl)phenyl]phenyl]indole
InChI:
InChI=1S/C48H32N2/c1-3-11-37-29-41(19-17-33(37)9-1)47-31-39-13-5-7-15-45(39)49(47)43-25-21-35(22-26-43)36-23-27-44(28-24-36)50-46-16-8-6-14-40(46)32-48(50)42-20-18-34-10-2-4-12-38(34)30-42/h1-32H
InChI Key:
WRCUUCGWQBMAHX-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)n(c1ccc(cc1)c1ccc(cc1)n1c(cc3c1cccc3)c1ccc3c(c1)cccc3)c(c2)c1ccc2c(c1)cccc2
Properties
Complexity:
1020
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
636.257g/mol
Formal Charge:
0
Heavy Atom Count:
50
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
636.798g/mol
Monoisotopic Mass:
636.257g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
12.8
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