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817642-18-5 | Anthracene, 9,9'-(1,3-phenylene)bis[10-(9,9-dimethyl-9H-fluoren-2-yl)-
CAS No: 817642-18-5 Catalog No: AG0056YE MDL No:
Product Description
Catalog Number:
AG0056YE
Chemical Name:
Anthracene, 9,9'-(1,3-phenylene)bis[10-(9,9-dimethyl-9H-fluoren-2-yl)-
CAS Number:
817642-18-5
Molecular Formula:
C64H46
Molecular Weight:
815.0500
IUPAC Name:
9-(9,9-dimethylfluoren-2-yl)-10-[3-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]phenyl]anthracene
InChI:
InChI=1S/C64H46/c1-63(2)55-30-15-13-20-43(55)45-34-32-41(37-57(45)63)61-51-26-9-5-22-47(51)59(48-23-6-10-27-52(48)61)39-18-17-19-40(36-39)60-49-24-7-11-28-53(49)62(54-29-12-8-25-50(54)60)42-33-35-46-44-21-14-16-31-56(44)64(3,4)58(46)38-42/h5-38H,1-4H3
InChI Key:
FNWJHCQTKNKOKM-UHFFFAOYSA-N
SMILES:
CC1(C)c2cc(ccc2c2c1cccc2)c1c2ccccc2c(c2c1cccc2)c1cccc(c1)c1c2ccccc2c(c2c1cccc2)c1ccc2c(c1)C(C)(C)c1c2cccc1
Properties
Complexity:
1450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
814.36g/mol
Formal Charge:
0
Heavy Atom Count:
64
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
815.072g/mol
Monoisotopic Mass:
814.36g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
18.4
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