9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene

C32H32 — CID 143306948

IUPAC9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene
SMILESCCC(C)(c1ccccc1)c1ccc2c(c1)C(C)(C)c1cc(-c3ccc(C)cc3)ccc1-2
InChIInChI=1S/C32H32/c1-6-32(5,25-10-8-7-9-11-25)26-17-19-28-27-18-16-24(23-14-12-22(2)13-15-23)20-29(27)31(3,4)30(28)21-26/h7-21H,6H2,1-5H3
InChIKeyCLOXUKHJJZOFKT-UHFFFAOYSA-N
MW416.61 g/mol
LogP8.68
Rot. Bonds4

About 9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene

9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene (PubChem CID 143306948) has the molecular formula C32H32 and a molecular weight of 416.61 g/mol. Its IUPAC name is 9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene.

Molecular Properties

Compound Name9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene
PubChem CID143306948
Molecular FormulaC32H32
Molecular Weight416.61 g/mol
Exact Mass416.25
IUPAC Name9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene
SMILESCCC(C)(c1ccccc1)c1ccc2c(c1)C(C)(C)c1cc(-c3ccc(C)cc3)ccc1-2
InChIInChI=1S/C32H32/c1-6-32(5,25-10-8-7-9-11-25)26-17-19-28-27-18-16-24(23-14-12-22(2)13-15-23)20-29(27)31(3,4)30(28)21-26/h7-21H,6H2,1-5H3
InChIKeyCLOXUKHJJZOFKT-UHFFFAOYSA-N
XLogP8.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.61
LogP ≤ 58.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-tert-butyl-7-[4-[9,9-dimethyl-7-(3-phenylphenyl)fluoren-2-yl]phenyl]-9,9-dimethylfluorene
CID 58881044
N-[4-[9,9-dimethyl-7-[4-(4-methyl-N-[4-(3-phenylphenyl)phenyl]anilino)phenyl]fluoren-2-yl]phenyl]-4-methyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 58939361
2-(3,5-diphenylphenyl)-7-[4-[7-(3,5-diphenylphenyl)-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluorene
CID 58880913
2,7-bis(3,5-diphenylphenyl)-9,9-dimethylfluorene
CID 59217114
3,5-bis(7-tert-butyl-9,9-dimethylfluoren-2-yl)-N,N-bis(4-phenylphenyl)aniline
CID 58389701
4-[3-[9,9-dimethyl-7-(4-methylphenyl)fluoren-2-yl]pentan-3-yl]-9,9'-spirobi[fluorene]
CID 143306928
6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene
CID 144585061
2,9,9-trimethyl-7-[3-(7,9,9-trimethylfluoren-2-yl)phenyl]fluorene
CID 58943521
1-(2-phenylbutan-2-yl)-4-[4-(2-phenylpropan-2-yl)phenyl]benzene
CID 173279363
ethane;6,6,12,12-tetramethyl-2-(4-methylphenyl)indeno[1,2-b]fluorene
CID 144585060
9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene
CID 143017257
2-(4-methylphenyl)-4-phenyl-6-[4-(7,9,9-trimethylfluoren-2-yl)phenyl]-1,3,5-triazine
CID 20724533

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene?
The IUPAC name of 9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene (CID 143306948) is 9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene.
What is the SMILES notation for 9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene?
The canonical SMILES for 9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene is CCC(C)(c1ccccc1)c1ccc2c(c1)C(C)(C)c1cc(-c3ccc(C)cc3)ccc1-2.
What is the InChIKey of 9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene?
The InChIKey is CLOXUKHJJZOFKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H32/c1-6-32(5,25-10-8-7-9-11-25)26-17-19-28-27-18-16-24(23-14-12-22(2)13-15-23)20-29(27)31(3,4)30(28)21-26/h7-21H,6H2,1-5H3.
What are the key properties of 9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene?
9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene has a molecular weight of 416.61 g/mol, XLogP of 8.68, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene is sourced from PubChem (CID 143306948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).