2-(cyclopenten-1-yl)-1,4-difluorobenzene

C11H10F2 — CID 149112828

IUPAC2-(cyclopenten-1-yl)-1,4-difluorobenzene
SMILESFc1ccc(F)c(C2=CCCC2)c1
InChIInChI=1S/C11H10F2/c12-9-5-6-11(13)10(7-9)8-3-1-2-4-8/h3,5-7H,1-2,4H2
InChIKeyQXPJOYLFIRUIOW-UHFFFAOYSA-N
MW180.20 g/mol
LogP3.53
Rot. Bonds1

About 2-(cyclopenten-1-yl)-1,4-difluorobenzene

2-(cyclopenten-1-yl)-1,4-difluorobenzene (PubChem CID 149112828) has the molecular formula C11H10F2 and a molecular weight of 180.20 g/mol. Its IUPAC name is 2-(cyclopenten-1-yl)-1,4-difluorobenzene.

Molecular Properties

Compound Name2-(cyclopenten-1-yl)-1,4-difluorobenzene
PubChem CID149112828
Molecular FormulaC11H10F2
Molecular Weight180.20 g/mol
Exact Mass180.08
IUPAC Name2-(cyclopenten-1-yl)-1,4-difluorobenzene
SMILESFc1ccc(F)c(C2=CCCC2)c1
InChIInChI=1S/C11H10F2/c12-9-5-6-11(13)10(7-9)8-3-1-2-4-8/h3,5-7H,1-2,4H2
InChIKeyQXPJOYLFIRUIOW-UHFFFAOYSA-N
XLogP3.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.20
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopenten-1-yl)-1,4-difluorobenzene?
The IUPAC name of 2-(cyclopenten-1-yl)-1,4-difluorobenzene (CID 149112828) is 2-(cyclopenten-1-yl)-1,4-difluorobenzene.
What is the SMILES notation for 2-(cyclopenten-1-yl)-1,4-difluorobenzene?
The canonical SMILES for 2-(cyclopenten-1-yl)-1,4-difluorobenzene is Fc1ccc(F)c(C2=CCCC2)c1.
What is the InChIKey of 2-(cyclopenten-1-yl)-1,4-difluorobenzene?
The InChIKey is QXPJOYLFIRUIOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2/c12-9-5-6-11(13)10(7-9)8-3-1-2-4-8/h3,5-7H,1-2,4H2.
What are the key properties of 2-(cyclopenten-1-yl)-1,4-difluorobenzene?
2-(cyclopenten-1-yl)-1,4-difluorobenzene has a molecular weight of 180.20 g/mol, XLogP of 3.53, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopenten-1-yl)-1,4-difluorobenzene is sourced from PubChem (CID 149112828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).