2,9,9-trimethyl-1-(2-methylphenyl)fluorene

C23H22 — CID 145007121

IUPAC2,9,9-trimethyl-1-(2-methylphenyl)fluorene
SMILESCc1ccccc1-c1c(C)ccc2c1C(C)(C)c1ccccc1-2
InChIInChI=1S/C23H22/c1-15-9-5-6-10-17(15)21-16(2)13-14-19-18-11-7-8-12-20(18)23(3,4)22(19)21/h5-14H,1-4H3
InChIKeyARXPKKMTWVLACV-UHFFFAOYSA-N
MW298.43 g/mol
LogP6.28
Rot. Bonds1

About 2,9,9-trimethyl-1-(2-methylphenyl)fluorene

2,9,9-trimethyl-1-(2-methylphenyl)fluorene (PubChem CID 145007121) has the molecular formula C23H22 and a molecular weight of 298.43 g/mol. Its IUPAC name is 2,9,9-trimethyl-1-(2-methylphenyl)fluorene.

Molecular Properties

Compound Name2,9,9-trimethyl-1-(2-methylphenyl)fluorene
PubChem CID145007121
Molecular FormulaC23H22
Molecular Weight298.43 g/mol
Exact Mass298.17
IUPAC Name2,9,9-trimethyl-1-(2-methylphenyl)fluorene
SMILESCc1ccccc1-c1c(C)ccc2c1C(C)(C)c1ccccc1-2
InChIInChI=1S/C23H22/c1-15-9-5-6-10-17(15)21-16(2)13-14-19-18-11-7-8-12-20(18)23(3,4)22(19)21/h5-14H,1-4H3
InChIKeyARXPKKMTWVLACV-UHFFFAOYSA-N
XLogP6.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.43
LogP ≤ 56.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,9,9-trimethylfluoren-1-amine
CID 142604621
5-deuterio-1-methyl-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium
CID 161312540
1-methyl-2-(2,9,9-trimethylfluoren-1-yl)quinolin-1-ium
CID 164787286
ethane;4,9,9-trimethylfluorene
CID 123917181
9,9,10,10-tetramethyl-1,2,3,4,5,6,7,8-octakis(2-methylphenyl)anthracene
CID 59649072
9,9-dimethyl-2-(2-methylphenyl)fluorene
CID 58389997
1-methyl-2-(2,5,9,9-tetramethylfluoren-1-yl)pyridin-1-ium
CID 159863789
2-(9,9-dimethylfluoren-1-yl)-9,9'-spirobi[fluorene]-1-amine
CID 175695461
toluene;bis(1,9,9-trimethylfluorene);bis(2,9,9-trimethylfluorene);bis(3,9,9-trimethylfluorene);bis(4,9,9-trimethylfluorene)
CID 160789505
1-methyl-4-(1,1,1,2-tetradeuteriopropan-2-yl)-2-(2,9,9-trimethylfluoren-1-yl)pyridin-1-ium
CID 158916879
4'-methyl-9,9'-spirobi[fluorene]
CID 91359179
1,6,9-trimethyl-6-azoniapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 140907972

Frequently Asked Questions

What is the IUPAC name of 2,9,9-trimethyl-1-(2-methylphenyl)fluorene?
The IUPAC name of 2,9,9-trimethyl-1-(2-methylphenyl)fluorene (CID 145007121) is 2,9,9-trimethyl-1-(2-methylphenyl)fluorene.
What is the SMILES notation for 2,9,9-trimethyl-1-(2-methylphenyl)fluorene?
The canonical SMILES for 2,9,9-trimethyl-1-(2-methylphenyl)fluorene is Cc1ccccc1-c1c(C)ccc2c1C(C)(C)c1ccccc1-2.
What is the InChIKey of 2,9,9-trimethyl-1-(2-methylphenyl)fluorene?
The InChIKey is ARXPKKMTWVLACV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22/c1-15-9-5-6-10-17(15)21-16(2)13-14-19-18-11-7-8-12-20(18)23(3,4)22(19)21/h5-14H,1-4H3.
What are the key properties of 2,9,9-trimethyl-1-(2-methylphenyl)fluorene?
2,9,9-trimethyl-1-(2-methylphenyl)fluorene has a molecular weight of 298.43 g/mol, XLogP of 6.28, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9,9-trimethyl-1-(2-methylphenyl)fluorene is sourced from PubChem (CID 145007121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).