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1262783-41-4 | 9H-Carbazole, 9,9'-(2,2'-dimethyl[1,1'-biphenyl]-4,4'-diyl)bis[3,6-dimethyl-
CAS No: 1262783-41-4 Catalog No: AG000SGV MDL No:
Product Description
Catalog Number:
AG000SGV
Chemical Name:
9H-Carbazole, 9,9'-(2,2'-dimethyl[1,1'-biphenyl]-4,4'-diyl)bis[3,6-dimethyl-
CAS Number:
1262783-41-4
Molecular Formula:
C42H36N2
Molecular Weight:
568.7486
IUPAC Name:
1-[4-[4-(3,6-dimethyl-9H-carbazol-1-yl)-2-methylphenyl]-3-methylphenyl]-3,6-dimethyl-9H-carbazole
InChI:
InChI=1S/C42H36N2/c1-23-7-13-39-35(15-23)37-19-25(3)17-33(41(37)43-39)29-9-11-31(27(5)21-29)32-12-10-30(22-28(32)6)34-18-26(4)20-38-36-16-24(2)8-14-40(36)44-42(34)38/h7-22,43-44H,1-6H3
InChI Key:
MQMDNUMAQBAGSR-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c1cc(C)ccc1n2c1ccc(c(c1)C)c1ccc(cc1C)n1c2ccc(cc2c2c1ccc(c2)C)C
Properties
Complexity:
914
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
568.288g/mol
Formal Charge:
0
Heavy Atom Count:
44
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
568.764g/mol
Monoisotopic Mass:
568.288g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
31.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
11.9
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