2,4-ditert-butyl-9,9-dimethylfluorene

C23H30 — CID 140861200

IUPAC2,4-ditert-butyl-9,9-dimethylfluorene
SMILESCC(C)(C)c1cc(C(C)(C)C)c2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C23H30/c1-21(2,3)15-13-18(22(4,5)6)20-16-11-9-10-12-17(16)23(7,8)19(20)14-15/h9-14H,1-8H3
InChIKeyBCIDEXXTPPGEBM-UHFFFAOYSA-N
MW306.49 g/mol
LogP6.59
Rot. Bonds

About 2,4-ditert-butyl-9,9-dimethylfluorene

2,4-ditert-butyl-9,9-dimethylfluorene (PubChem CID 140861200) has the molecular formula C23H30 and a molecular weight of 306.49 g/mol. Its IUPAC name is 2,4-ditert-butyl-9,9-dimethylfluorene.

Molecular Properties

Compound Name2,4-ditert-butyl-9,9-dimethylfluorene
PubChem CID140861200
Molecular FormulaC23H30
Molecular Weight306.49 g/mol
Exact Mass306.23
IUPAC Name2,4-ditert-butyl-9,9-dimethylfluorene
SMILESCC(C)(C)c1cc(C(C)(C)C)c2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C23H30/c1-21(2,3)15-13-18(22(4,5)6)20-16-11-9-10-12-17(16)23(7,8)19(20)14-15/h9-14H,1-8H3
InChIKeyBCIDEXXTPPGEBM-UHFFFAOYSA-N
XLogP6.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.49
LogP ≤ 56.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

5-[10-(4-tert-butylphenyl)anthracen-9-yl]-7,7-dimethylbenzo[c]fluorene
CID 123566390
1-tert-butyl-7-(4-tert-butyl-9,9-dimethylfluoren-2-yl)dibenzofuran
CID 167063858
2,7-ditert-butyl-9,9-dimethyl-4-[4-(2-phenylphenyl)phenyl]fluorene
CID 58986957
4-(9,9-dimethylfluoren-4-yl)-9,9-dimethylfluorene
CID 166563569
1,5-ditert-butyl-9,9-dimethylfluorene;1,6-ditert-butyl-9,9-dimethylfluorene;1,7-ditert-butyl-9,9-dimethylfluorene;1,8-ditert-butyl-9,9-dimethylfluorene;2,5-ditert-butyl-9,9-dimethylfluorene
CID 158121103
1-tert-butyl-9,9-dimethylfluorene;2-tert-butyl-9,9-dimethylfluorene;3-tert-butyl-9,9-dimethylfluorene;4-tert-butyl-9,9-dimethylfluorene;2-tert-butyl-9,9'-spirobi[fluorene];3-tert-butyl-9,9'-spirobi[fluorene];4-tert-butyl-9,9'-spirobi[fluorene]
CID 165098944
6,8-ditert-butyl-N-(6,8-ditert-butyl-9,9-dimethylfluoren-2-yl)-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-4-amine
CID 176605468
17-tert-butyl-6-(9,9-dimethylfluoren-2-yl)-9,9-dimethylhexacyclo[13.6.2.02,10.03,8.012,22.019,23]tricosa-1(22),2(10),3(8),4,6,11,13,15,17,19(23),20-undecaene
CID 58402162
6,8-ditert-butyl-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-phenylfluoren-4-amine
CID 177067969
N-[2-(5,7-ditert-butyl-9,9-dimethylfluoren-4-yl)phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 170141724
2,7-ditert-butyl-9,9-dimethyl-4-[4-(4-phenylphenyl)phenyl]fluorene
CID 58986922
2,7-ditert-butyl-9,9-dimethyl-4-[4-[4-(4-phenylphenyl)phenyl]phenyl]fluorene
CID 58986902

Frequently Asked Questions

What is the IUPAC name of 2,4-ditert-butyl-9,9-dimethylfluorene?
The IUPAC name of 2,4-ditert-butyl-9,9-dimethylfluorene (CID 140861200) is 2,4-ditert-butyl-9,9-dimethylfluorene.
What is the SMILES notation for 2,4-ditert-butyl-9,9-dimethylfluorene?
The canonical SMILES for 2,4-ditert-butyl-9,9-dimethylfluorene is CC(C)(C)c1cc(C(C)(C)C)c2c(c1)C(C)(C)c1ccccc1-2.
What is the InChIKey of 2,4-ditert-butyl-9,9-dimethylfluorene?
The InChIKey is BCIDEXXTPPGEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30/c1-21(2,3)15-13-18(22(4,5)6)20-16-11-9-10-12-17(16)23(7,8)19(20)14-15/h9-14H,1-8H3.
What are the key properties of 2,4-ditert-butyl-9,9-dimethylfluorene?
2,4-ditert-butyl-9,9-dimethylfluorene has a molecular weight of 306.49 g/mol, XLogP of 6.59, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-ditert-butyl-9,9-dimethylfluorene is sourced from PubChem (CID 140861200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).