1-ethenyl-2-ethyl-9H-fluorene

C17H16 — CID 158586423

IUPAC1-ethenyl-2-ethyl-9H-fluorene
SMILESC=Cc1c(CC)ccc2c1Cc1ccccc1-2
InChIInChI=1S/C17H16/c1-3-12-9-10-16-15-8-6-5-7-13(15)11-17(16)14(12)4-2/h4-10H,2-3,11H2,1H3
InChIKeyHTWNQZIJTCJLFI-UHFFFAOYSA-N
MW220.31 g/mol
LogP4.46
Rot. Bonds2

About 1-ethenyl-2-ethyl-9H-fluorene

1-ethenyl-2-ethyl-9H-fluorene (PubChem CID 158586423) has the molecular formula C17H16 and a molecular weight of 220.31 g/mol. Its IUPAC name is 1-ethenyl-2-ethyl-9H-fluorene.

Molecular Properties

Compound Name1-ethenyl-2-ethyl-9H-fluorene
PubChem CID158586423
Molecular FormulaC17H16
Molecular Weight220.31 g/mol
Exact Mass220.13
IUPAC Name1-ethenyl-2-ethyl-9H-fluorene
SMILESC=Cc1c(CC)ccc2c1Cc1ccccc1-2
InChIInChI=1S/C17H16/c1-3-12-9-10-16-15-8-6-5-7-13(15)11-17(16)14(12)4-2/h4-10H,2-3,11H2,1H3
InChIKeyHTWNQZIJTCJLFI-UHFFFAOYSA-N
XLogP4.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2-ethyl-9H-fluorene?
The IUPAC name of 1-ethenyl-2-ethyl-9H-fluorene (CID 158586423) is 1-ethenyl-2-ethyl-9H-fluorene.
What is the SMILES notation for 1-ethenyl-2-ethyl-9H-fluorene?
The canonical SMILES for 1-ethenyl-2-ethyl-9H-fluorene is C=Cc1c(CC)ccc2c1Cc1ccccc1-2.
What is the InChIKey of 1-ethenyl-2-ethyl-9H-fluorene?
The InChIKey is HTWNQZIJTCJLFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16/c1-3-12-9-10-16-15-8-6-5-7-13(15)11-17(16)14(12)4-2/h4-10H,2-3,11H2,1H3.
What are the key properties of 1-ethenyl-2-ethyl-9H-fluorene?
1-ethenyl-2-ethyl-9H-fluorene has a molecular weight of 220.31 g/mol, XLogP of 4.46, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2-ethyl-9H-fluorene is sourced from PubChem (CID 158586423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).