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1643479-47-3 | 3,3'-Bi-9H-carbazole, 9-[1,1'-biphenyl]-3-yl-9'-[1,1'-biphenyl]-4-yl-
CAS No: 1643479-47-3 Catalog No: AG001UTB MDL No:
Product Description
Catalog Number:
AG001UTB
Chemical Name:
3,3'-Bi-9H-carbazole, 9-[1,1'-biphenyl]-3-yl-9'-[1,1'-biphenyl]-4-yl-
CAS Number:
1643479-47-3
Molecular Formula:
C48H32N2
Molecular Weight:
636.7811
IUPAC Name:
9-(3-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
InChI:
InChI=1S/C48H32N2/c1-3-12-33(13-4-1)35-22-26-39(27-23-35)49-45-20-9-7-18-41(45)43-31-37(24-28-47(43)49)38-25-29-48-44(32-38)42-19-8-10-21-46(42)50(48)40-17-11-16-36(30-40)34-14-5-2-6-15-34/h1-32H
InChI Key:
ZAYDYNVXBIQORO-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1ccc(cc1)n1c2ccccc2c2c1ccc(c2)c1ccc2c(c1)c1ccccc1n2c1cccc(c1)c1ccccc1
Properties
Complexity:
1100
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:
13
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