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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Related Compounds

2-bromo-9,10-dihydro-8H-cyclohepta[b][1]benzofuran
CID 134504475
6,8-dimethyl-2,3-dihydro-1H-dibenzofuran-4-one
CID 10822519
10-amino-17-bromo-13-oxa-9-azoniatetracyclo[9.8.0.02,8.014,19]nonadeca-1(11),2(8),9,14(19),15,17-hexaen-12-one
CID 2228435
7-bromo-2-hydroxy-1,2,3,4-tetrahydroxanthen-9-one
CID 12952273
7-bromo-1-(4-bromophenyl)-2-(oxolan-2-ylmethyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
CID 18820312
8-bromodibenzofuran-2-carbaldehyde
CID 23559412
6-bromo-2-[(2S)-oxolan-2-yl]chromen-4-one
CID 175362887
5,14-dimethyl-18-oxatetracyclo[9.7.0.02,7.012,17]octadeca-1(11),2(7),3,5,12(17),13,15-heptaene
CID 90227674
6-bromo-9-(4-bromobenzoyl)-3,4-dihydro-2H-carbazol-1-one
CID 143235078
7-bromo-2-methoxy-1,2,3,4-tetrahydroxanthen-9-one
CID 12952274
6-bromo-4-chloro-2-oxochromene-3-carbaldehyde
CID 4649129
2-bromo-7-methylxanthen-9-one;ethane
CID 143958066

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).