9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene

C25H34 — CID 143017257

IUPAC9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene
SMILESCCC(C)(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)(C)CC)ccc1-2
InChIInChI=1S/C25H34/c1-9-23(3,4)17-11-13-19-20-14-12-18(24(5,6)10-2)16-22(20)25(7,8)21(19)15-17/h11-16H,9-10H2,1-8H3
InChIKeyCCAVPSYLDOEJER-UHFFFAOYSA-N
MW334.55 g/mol
LogP7.37
Rot. Bonds4

About 9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene

9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene (PubChem CID 143017257) has the molecular formula C25H34 and a molecular weight of 334.55 g/mol. Its IUPAC name is 9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene.

Molecular Properties

Compound Name9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene
PubChem CID143017257
Molecular FormulaC25H34
Molecular Weight334.55 g/mol
Exact Mass334.27
IUPAC Name9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene
SMILESCCC(C)(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)(C)CC)ccc1-2
InChIInChI=1S/C25H34/c1-9-23(3,4)17-11-13-19-20-14-12-18(24(5,6)10-2)16-22(20)25(7,8)21(19)15-17/h11-16H,9-10H2,1-8H3
InChIKeyCCAVPSYLDOEJER-UHFFFAOYSA-N
XLogP7.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.55
LogP ≤ 57.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-(1-bromoethyl)-9,9-dimethyl-7-(2-methylbutan-2-yl)fluorene
CID 90463480
3-ethyl-3-methyl-5-(2-methylbutan-2-yl)-2H-inden-1-one
CID 154721544
2-(2-methylbutan-2-yl)-9,9-dioctylfluorene
CID 143498644
2-methyl-7-(2-methylbutan-2-yl)-9,9-dioctylfluorene
CID 148971086
9,9-dimethyl-2-(4-methylphenyl)-7-(2-phenylbutan-2-yl)fluorene
CID 143306948
7-[3,6-bis(2-methylbutan-2-yl)carbazol-9-yl]-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine
CID 144745751
9-(3,4-dimethylphenyl)-9-(4-methoxy-3-methylphenyl)-2,7-bis(2-methylbutan-2-yl)fluorene
CID 163998765
7-(2-fluoropropan-2-yl)-9,9-dimethylfluorene-2-thiol
CID 178015976
5,5,8,8,12,12,16,16,19,19-decamethylpentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),10,13,15(20)-hexaene;2,7-ditert-butyl-9,9-dimethylfluorene
CID 159255668
2-tert-butyl-7-[4-[9,9-dimethyl-7-(3-phenylphenyl)fluoren-2-yl]phenyl]-9,9-dimethylfluorene
CID 58881044
2,7-ditert-butyl-4-[4-(2,7-ditert-butyl-9,9-dimethylfluoren-4-yl)phenyl]-9,9-dimethylfluorene
CID 58986909
1-methyl-2,4-bis(2-methylbutan-2-yl)benzene
CID 20667880

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene?
The IUPAC name of 9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene (CID 143017257) is 9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene.
What is the SMILES notation for 9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene?
The canonical SMILES for 9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene is CCC(C)(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)(C)CC)ccc1-2.
What is the InChIKey of 9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene?
The InChIKey is CCAVPSYLDOEJER-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H34/c1-9-23(3,4)17-11-13-19-20-14-12-18(24(5,6)10-2)16-22(20)25(7,8)21(19)15-17/h11-16H,9-10H2,1-8H3.
What are the key properties of 9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene?
9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene has a molecular weight of 334.55 g/mol, XLogP of 7.37, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-2,7-bis(2-methylbutan-2-yl)fluorene is sourced from PubChem (CID 143017257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).