7-bromo-6-fluoro-1-benzofuran

C8H4BrFO — CID 22144929

IUPAC7-bromo-6-fluoro-1-benzofuran
SMILESFc1ccc2ccoc2c1Br
InChIInChI=1S/C8H4BrFO/c9-7-6(10)2-1-5-3-4-11-8(5)7/h1-4H
InChIKeyRJUUDARDDHZUAB-UHFFFAOYSA-N
MW215.02 g/mol
LogP3.33
Rot. Bonds

About 7-bromo-6-fluoro-1-benzofuran

7-bromo-6-fluoro-1-benzofuran (PubChem CID 22144929) has the molecular formula C8H4BrFO and a molecular weight of 215.02 g/mol. Its IUPAC name is 7-bromo-6-fluoro-1-benzofuran.

Molecular Properties

Compound Name7-bromo-6-fluoro-1-benzofuran
PubChem CID22144929
Molecular FormulaC8H4BrFO
Molecular Weight215.02 g/mol
Exact Mass213.94
IUPAC Name7-bromo-6-fluoro-1-benzofuran
SMILESFc1ccc2ccoc2c1Br
InChIInChI=1S/C8H4BrFO/c9-7-6(10)2-1-5-3-4-11-8(5)7/h1-4H
InChIKeyRJUUDARDDHZUAB-UHFFFAOYSA-N
XLogP3.33
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.02
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-6-fluoro-1-benzofuran?
The IUPAC name of 7-bromo-6-fluoro-1-benzofuran (CID 22144929) is 7-bromo-6-fluoro-1-benzofuran.
What is the SMILES notation for 7-bromo-6-fluoro-1-benzofuran?
The canonical SMILES for 7-bromo-6-fluoro-1-benzofuran is Fc1ccc2ccoc2c1Br.
What is the InChIKey of 7-bromo-6-fluoro-1-benzofuran?
The InChIKey is RJUUDARDDHZUAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4BrFO/c9-7-6(10)2-1-5-3-4-11-8(5)7/h1-4H.
What are the key properties of 7-bromo-6-fluoro-1-benzofuran?
7-bromo-6-fluoro-1-benzofuran has a molecular weight of 215.02 g/mol, XLogP of 3.33, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-6-fluoro-1-benzofuran is sourced from PubChem (CID 22144929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).