2-ethyl-7,9,9-trimethylfluorene

C18H20 — CID 59167125

IUPAC2-ethyl-7,9,9-trimethylfluorene
SMILESCCc1ccc2c(c1)C(C)(C)c1cc(C)ccc1-2
InChIInChI=1S/C18H20/c1-5-13-7-9-15-14-8-6-12(2)10-16(14)18(3,4)17(15)11-13/h6-11H,5H2,1-4H3
InChIKeyYONKNJCABJTNMT-UHFFFAOYSA-N
MW236.36 g/mol
LogP4.86
Rot. Bonds1

About 2-ethyl-7,9,9-trimethylfluorene

2-ethyl-7,9,9-trimethylfluorene (PubChem CID 59167125) has the molecular formula C18H20 and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-ethyl-7,9,9-trimethylfluorene.

Molecular Properties

Compound Name2-ethyl-7,9,9-trimethylfluorene
PubChem CID59167125
Molecular FormulaC18H20
Molecular Weight236.36 g/mol
Exact Mass236.16
IUPAC Name2-ethyl-7,9,9-trimethylfluorene
SMILESCCc1ccc2c(c1)C(C)(C)c1cc(C)ccc1-2
InChIInChI=1S/C18H20/c1-5-13-7-9-15-14-8-6-12(2)10-16(14)18(3,4)17(15)11-13/h6-11H,5H2,1-4H3
InChIKeyYONKNJCABJTNMT-UHFFFAOYSA-N
XLogP4.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-7,9,9-trimethylfluorene?
The IUPAC name of 2-ethyl-7,9,9-trimethylfluorene (CID 59167125) is 2-ethyl-7,9,9-trimethylfluorene.
What is the SMILES notation for 2-ethyl-7,9,9-trimethylfluorene?
The canonical SMILES for 2-ethyl-7,9,9-trimethylfluorene is CCc1ccc2c(c1)C(C)(C)c1cc(C)ccc1-2.
What is the InChIKey of 2-ethyl-7,9,9-trimethylfluorene?
The InChIKey is YONKNJCABJTNMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20/c1-5-13-7-9-15-14-8-6-12(2)10-16(14)18(3,4)17(15)11-13/h6-11H,5H2,1-4H3.
What are the key properties of 2-ethyl-7,9,9-trimethylfluorene?
2-ethyl-7,9,9-trimethylfluorene has a molecular weight of 236.36 g/mol, XLogP of 4.86, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-7,9,9-trimethylfluorene is sourced from PubChem (CID 59167125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).