1,4-difluorobenzene

C6H4F2 — CID 10892

IUPAC1,4-difluorobenzene
SMILESFc1ccc(F)cc1
InChIInChI=1S/C6H4F2/c7-5-1-2-6(8)4-3-5/h1-4H
InChIKeyQUGUFLJIAFISSW-UHFFFAOYSA-N
MW114.09 g/mol
LogP1.96
Rot. Bonds

About 1,4-difluorobenzene

1,4-difluorobenzene (PubChem CID 10892) has the molecular formula C6H4F2 and a molecular weight of 114.09 g/mol. Its IUPAC name is 1,4-difluorobenzene.

Molecular Properties

Compound Name1,4-difluorobenzene
PubChem CID10892
Molecular FormulaC6H4F2
Molecular Weight114.09 g/mol
Exact Mass114.03
IUPAC Name1,4-difluorobenzene
SMILESFc1ccc(F)cc1
InChIInChI=1S/C6H4F2/c7-5-1-2-6(8)4-3-5/h1-4H
InChIKeyQUGUFLJIAFISSW-UHFFFAOYSA-N
XLogP1.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.09
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,4-difluorobenzene?
The IUPAC name of 1,4-difluorobenzene (CID 10892) is 1,4-difluorobenzene.
What is the SMILES notation for 1,4-difluorobenzene?
The canonical SMILES for 1,4-difluorobenzene is Fc1ccc(F)cc1.
What is the InChIKey of 1,4-difluorobenzene?
The InChIKey is QUGUFLJIAFISSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F2/c7-5-1-2-6(8)4-3-5/h1-4H.
What are the key properties of 1,4-difluorobenzene?
1,4-difluorobenzene has a molecular weight of 114.09 g/mol, XLogP of 1.96, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-difluorobenzene is sourced from PubChem (CID 10892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).