9,9-diethyl-4-methylfluorene

C18H20 — CID 145474512

IUPAC9,9-diethyl-4-methylfluorene
SMILESCCC1(CC)c2ccccc2-c2c(C)cccc21
InChIInChI=1S/C18H20/c1-4-18(5-2)15-11-7-6-10-14(15)17-13(3)9-8-12-16(17)18/h6-12H,4-5H2,1-3H3
InChIKeyQCEUDZMQYIOTPX-UHFFFAOYSA-N
MW236.36 g/mol
LogP5.08
Rot. Bonds2

About 9,9-diethyl-4-methylfluorene

9,9-diethyl-4-methylfluorene (PubChem CID 145474512) has the molecular formula C18H20 and a molecular weight of 236.36 g/mol. Its IUPAC name is 9,9-diethyl-4-methylfluorene.

Molecular Properties

Compound Name9,9-diethyl-4-methylfluorene
PubChem CID145474512
Molecular FormulaC18H20
Molecular Weight236.36 g/mol
Exact Mass236.16
IUPAC Name9,9-diethyl-4-methylfluorene
SMILESCCC1(CC)c2ccccc2-c2c(C)cccc21
InChIInChI=1S/C18H20/c1-4-18(5-2)15-11-7-6-10-14(15)17-13(3)9-8-12-16(17)18/h6-12H,4-5H2,1-3H3
InChIKeyQCEUDZMQYIOTPX-UHFFFAOYSA-N
XLogP5.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.36
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9,9-diethyl-4-methylfluorene?
The IUPAC name of 9,9-diethyl-4-methylfluorene (CID 145474512) is 9,9-diethyl-4-methylfluorene.
What is the SMILES notation for 9,9-diethyl-4-methylfluorene?
The canonical SMILES for 9,9-diethyl-4-methylfluorene is CCC1(CC)c2ccccc2-c2c(C)cccc21.
What is the InChIKey of 9,9-diethyl-4-methylfluorene?
The InChIKey is QCEUDZMQYIOTPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20/c1-4-18(5-2)15-11-7-6-10-14(15)17-13(3)9-8-12-16(17)18/h6-12H,4-5H2,1-3H3.
What are the key properties of 9,9-diethyl-4-methylfluorene?
9,9-diethyl-4-methylfluorene has a molecular weight of 236.36 g/mol, XLogP of 5.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-diethyl-4-methylfluorene is sourced from PubChem (CID 145474512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).