9-ethyl-9-propylfluorene

C18H20 — CID 123584741

IUPAC9-ethyl-9-propylfluorene
SMILESCCCC1(CC)c2ccccc2-c2ccccc21
InChIInChI=1S/C18H20/c1-3-13-18(4-2)16-11-7-5-9-14(16)15-10-6-8-12-17(15)18/h5-12H,3-4,13H2,1-2H3
InChIKeyCKFOKMUQSRHJOY-UHFFFAOYSA-N
MW236.36 g/mol
LogP5.16
Rot. Bonds3

About 9-ethyl-9-propylfluorene

9-ethyl-9-propylfluorene (PubChem CID 123584741) has the molecular formula C18H20 and a molecular weight of 236.36 g/mol. Its IUPAC name is 9-ethyl-9-propylfluorene.

Molecular Properties

Compound Name9-ethyl-9-propylfluorene
PubChem CID123584741
Molecular FormulaC18H20
Molecular Weight236.36 g/mol
Exact Mass236.16
IUPAC Name9-ethyl-9-propylfluorene
SMILESCCCC1(CC)c2ccccc2-c2ccccc21
InChIInChI=1S/C18H20/c1-3-13-18(4-2)16-11-7-5-9-14(16)15-10-6-8-12-17(15)18/h5-12H,3-4,13H2,1-2H3
InChIKeyCKFOKMUQSRHJOY-UHFFFAOYSA-N
XLogP5.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.36
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-9-propylfluorene?
The IUPAC name of 9-ethyl-9-propylfluorene (CID 123584741) is 9-ethyl-9-propylfluorene.
What is the SMILES notation for 9-ethyl-9-propylfluorene?
The canonical SMILES for 9-ethyl-9-propylfluorene is CCCC1(CC)c2ccccc2-c2ccccc21.
What is the InChIKey of 9-ethyl-9-propylfluorene?
The InChIKey is CKFOKMUQSRHJOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20/c1-3-13-18(4-2)16-11-7-5-9-14(16)15-10-6-8-12-17(15)18/h5-12H,3-4,13H2,1-2H3.
What are the key properties of 9-ethyl-9-propylfluorene?
9-ethyl-9-propylfluorene has a molecular weight of 236.36 g/mol, XLogP of 5.16, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-9-propylfluorene is sourced from PubChem (CID 123584741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).