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247074-90-4

247074-90-4 | 9H-Fluoren-9-one, 2,7-bis[bis(4-butylphenyl)amino]-

CAS No: 247074-90-4 Catalog No: AG002P4V MDL No:

Product Description

Catalog Number:
AG002P4V
Chemical Name:
9H-Fluoren-9-one, 2,7-bis[bis(4-butylphenyl)amino]-
CAS Number:
247074-90-4
Molecular Formula:
C53H58N2O
Molecular Weight:
739.0404
IUPAC Name:
2,7-bis(4-butyl-N-(4-butylphenyl)anilino)fluoren-9-one
InChI:
InChI=1S/C53H58N2O/c1-5-9-13-39-17-25-43(26-18-39)54(44-27-19-40(20-28-44)14-10-6-2)47-33-35-49-50-36-34-48(38-52(50)53(56)51(49)37-47)55(45-29-21-41(22-30-45)15-11-7-3)46-31-23-42(24-32-46)16-12-8-4/h17-38H,5-16H2,1-4H3
InChI Key:
MOLHCSMEUPAJEH-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(cc1)N(c1ccc(cc1)CCCC)c1ccc2c(c1)C(=O)c1c2ccc(c1)N(c1ccc(cc1)CCCC)c1ccc(cc1)CCCC

Properties

Complexity:
979  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
738.455g/mol
Formal Charge:
0
Heavy Atom Count:
56  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
739.06g/mol
Monoisotopic Mass:
738.455g/mol
Rotatable Bond Count:
18  
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
17.2  

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