8-bromo-2,3-dihydro-1H-dibenzofuran-4-one

C12H9BrO2 — CID 10730368

IUPAC8-bromo-2,3-dihydro-1H-dibenzofuran-4-one
SMILESO=C1CCCc2c1oc1ccc(Br)cc21
InChIInChI=1S/C12H9BrO2/c13-7-4-5-11-9(6-7)8-2-1-3-10(14)12(8)15-11/h4-6H,1-3H2
InChIKeyJYBFVGPMJUVNKE-UHFFFAOYSA-N
MW265.11 g/mol
LogP3.71
Rot. Bonds

About 8-bromo-2,3-dihydro-1H-dibenzofuran-4-one

8-bromo-2,3-dihydro-1H-dibenzofuran-4-one (PubChem CID 10730368) has the molecular formula C12H9BrO2 and a molecular weight of 265.11 g/mol. Its IUPAC name is 8-bromo-2,3-dihydro-1H-dibenzofuran-4-one.

Molecular Properties

Compound Name8-bromo-2,3-dihydro-1H-dibenzofuran-4-one
PubChem CID10730368
Molecular FormulaC12H9BrO2
Molecular Weight265.11 g/mol
Exact Mass263.98
IUPAC Name8-bromo-2,3-dihydro-1H-dibenzofuran-4-one
SMILESO=C1CCCc2c1oc1ccc(Br)cc21
InChIInChI=1S/C12H9BrO2/c13-7-4-5-11-9(6-7)8-2-1-3-10(14)12(8)15-11/h4-6H,1-3H2
InChIKeyJYBFVGPMJUVNKE-UHFFFAOYSA-N
XLogP3.71
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.11
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-bromo-2,3-dihydro-1H-dibenzofuran-4-one?
The IUPAC name of 8-bromo-2,3-dihydro-1H-dibenzofuran-4-one (CID 10730368) is 8-bromo-2,3-dihydro-1H-dibenzofuran-4-one.
What is the SMILES notation for 8-bromo-2,3-dihydro-1H-dibenzofuran-4-one?
The canonical SMILES for 8-bromo-2,3-dihydro-1H-dibenzofuran-4-one is O=C1CCCc2c1oc1ccc(Br)cc21.
What is the InChIKey of 8-bromo-2,3-dihydro-1H-dibenzofuran-4-one?
The InChIKey is JYBFVGPMJUVNKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrO2/c13-7-4-5-11-9(6-7)8-2-1-3-10(14)12(8)15-11/h4-6H,1-3H2.
What are the key properties of 8-bromo-2,3-dihydro-1H-dibenzofuran-4-one?
8-bromo-2,3-dihydro-1H-dibenzofuran-4-one has a molecular weight of 265.11 g/mol, XLogP of 3.71, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-2,3-dihydro-1H-dibenzofuran-4-one is sourced from PubChem (CID 10730368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).