5,6-difluoro-2-benzofuran

C8H4F2O — CID 66980827

IUPAC5,6-difluoro-2-benzofuran
SMILESFc1cc2cocc2cc1F
InChIInChI=1S/C8H4F2O/c9-7-1-5-3-11-4-6(5)2-8(7)10/h1-4H
InChIKeyLDELBVXYPADOLD-UHFFFAOYSA-N
MW154.11 g/mol
LogP2.71
Rot. Bonds

About 5,6-difluoro-2-benzofuran

5,6-difluoro-2-benzofuran (PubChem CID 66980827) has the molecular formula C8H4F2O and a molecular weight of 154.11 g/mol. Its IUPAC name is 5,6-difluoro-2-benzofuran.

Molecular Properties

Compound Name5,6-difluoro-2-benzofuran
PubChem CID66980827
Molecular FormulaC8H4F2O
Molecular Weight154.11 g/mol
Exact Mass154.02
IUPAC Name5,6-difluoro-2-benzofuran
SMILESFc1cc2cocc2cc1F
InChIInChI=1S/C8H4F2O/c9-7-1-5-3-11-4-6(5)2-8(7)10/h1-4H
InChIKeyLDELBVXYPADOLD-UHFFFAOYSA-N
XLogP2.71
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.11
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5,6-difluoro-2-benzofuran?
The IUPAC name of 5,6-difluoro-2-benzofuran (CID 66980827) is 5,6-difluoro-2-benzofuran.
What is the SMILES notation for 5,6-difluoro-2-benzofuran?
The canonical SMILES for 5,6-difluoro-2-benzofuran is Fc1cc2cocc2cc1F.
What is the InChIKey of 5,6-difluoro-2-benzofuran?
The InChIKey is LDELBVXYPADOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4F2O/c9-7-1-5-3-11-4-6(5)2-8(7)10/h1-4H.
What are the key properties of 5,6-difluoro-2-benzofuran?
5,6-difluoro-2-benzofuran has a molecular weight of 154.11 g/mol, XLogP of 2.71, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-difluoro-2-benzofuran is sourced from PubChem (CID 66980827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).