6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene

C26H26 — CID 144770955

IUPAC6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene
SMILESCCC1(C)c2ccccc2-c2cc3c(cc21)-c1ccccc1C3(C)CC
InChIInChI=1S/C26H26/c1-5-25(3)21-13-9-7-11-17(21)19-16-24-20(15-23(19)25)18-12-8-10-14-22(18)26(24,4)6-2/h7-16H,5-6H2,1-4H3
InChIKeyHACKKILAJQDDAX-UHFFFAOYSA-N
MW338.49 g/mol
LogP7.08
Rot. Bonds2

About 6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene

6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene (PubChem CID 144770955) has the molecular formula C26H26 and a molecular weight of 338.49 g/mol. Its IUPAC name is 6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene.

Molecular Properties

Compound Name6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene
PubChem CID144770955
Molecular FormulaC26H26
Molecular Weight338.49 g/mol
Exact Mass338.20
IUPAC Name6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene
SMILESCCC1(C)c2ccccc2-c2cc3c(cc21)-c1ccccc1C3(C)CC
InChIInChI=1S/C26H26/c1-5-25(3)21-13-9-7-11-17(21)19-16-24-20(15-23(19)25)18-12-8-10-14-22(18)26(24,4)6-2/h7-16H,5-6H2,1-4H3
InChIKeyHACKKILAJQDDAX-UHFFFAOYSA-N
XLogP7.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.49
LogP ≤ 57.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

6,12-dimethyl-6,12-bis(prop-2-enyl)indeno[1,2-b]fluorene
CID 155763593
1-[9-ethyl-7-(9-ethyl-9-methylfluoren-2-yl)-9-methylfluoren-2-yl]pyrene
CID 123656103
9-methyl-9-propylfluorene
CID 13283188
9-ethyl-4,9-dimethylfluorene
CID 145360802
9-ethyl-9,10,10-trimethylanthracene
CID 91063128
2,9-dimethyl-9-propylfluorene
CID 58051803
9-methyl-9-[[4-[(9-methylfluoren-9-yl)methyl]phenyl]methyl]fluorene
CID 86051025
9-ethyl-9-methyl-10H-acridine
CID 22754271
9-ethyl-9-methyl-3,6-bis(trifluoromethyl)fluorene
CID 142535810
9-ethyl-9-methyl-N-(4-phenylphenyl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]fluoren-2-amine
CID 174022170
2-bromo-9-hexyl-9-methylfluorene
CID 141395535
2,7-bis(9,9-diethylfluoren-2-yl)-9,9-diethyl-3,6-dimethylfluorene
CID 59782418

Frequently Asked Questions

What is the IUPAC name of 6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene?
The IUPAC name of 6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene (CID 144770955) is 6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene.
What is the SMILES notation for 6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene?
The canonical SMILES for 6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene is CCC1(C)c2ccccc2-c2cc3c(cc21)-c1ccccc1C3(C)CC.
What is the InChIKey of 6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene?
The InChIKey is HACKKILAJQDDAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26/c1-5-25(3)21-13-9-7-11-17(21)19-16-24-20(15-23(19)25)18-12-8-10-14-22(18)26(24,4)6-2/h7-16H,5-6H2,1-4H3.
What are the key properties of 6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene?
6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene has a molecular weight of 338.49 g/mol, XLogP of 7.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,12-diethyl-6,12-dimethylindeno[1,2-b]fluorene is sourced from PubChem (CID 144770955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).