9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one

C19H16O3 — CID 146162479

IUPAC9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one
SMILESCOC12OC(c3ccccc3)CC1=CC(=O)c1ccccc12
InChIInChI=1S/C19H16O3/c1-21-19-14(11-17(20)15-9-5-6-10-16(15)19)12-18(22-19)13-7-3-2-4-8-13/h2-11,18H,12H2,1H3
InChIKeyPUDRMTKOBOLUTG-UHFFFAOYSA-N
MW292.33 g/mol
LogP3.77
Rot. Bonds2

About 9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one

9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one (PubChem CID 146162479) has the molecular formula C19H16O3 and a molecular weight of 292.33 g/mol. Its IUPAC name is 9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one.

Molecular Properties

Compound Name9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one
PubChem CID146162479
Molecular FormulaC19H16O3
Molecular Weight292.33 g/mol
Exact Mass292.11
IUPAC Name9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one
SMILESCOC12OC(c3ccccc3)CC1=CC(=O)c1ccccc12
InChIInChI=1S/C19H16O3/c1-21-19-14(11-17(20)15-9-5-6-10-16(15)19)12-18(22-19)13-7-3-2-4-8-13/h2-11,18H,12H2,1H3
InChIKeyPUDRMTKOBOLUTG-UHFFFAOYSA-N
XLogP3.77
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-methoxy-3-phenyl-2-benzofuran-1-one
CID 1224663
(12aR)-12a-methoxybenzo[c]xanthene-5,7-dione
CID 139091694
benzene;3,3-dimethyl-2-benzofuran-1-one;ethane;methoxymethane
CID 91422174
ethane;2-phenyl-2,3-dihydrochromen-4-one
CID 91018475
(1R,9R,10S,12R)-1-methoxy-10,12-diphenyl-13-oxatetracyclo[7.3.1.02,7.010,12]trideca-2,4,6-trien-8-one
CID 11610338
(1R,9R,10S,11R,12R)-1-methoxy-10,11,12-triphenyl-13-oxatetracyclo[7.3.1.02,7.010,12]trideca-2,4,6-trien-8-one
CID 11640841
3-methoxy-5-phenyl-1,3-oxazolidin-2-one
CID 13302506
(2S)-2-phenyl-1-oxaspiro[4.5]decan-4-one
CID 7070990
2,6-diphenyloxan-4-one
CID 500287
(3S,4R)-3-methoxy-3-methyl-4-phenyloxetan-2-one
CID 10058396
3-methoxy-3-methyl-2-benzofuran-1-one
CID 15483639
methyl (2R)-4-oxo-2-phenyl-2,3-dihydropyran-5-carboxylate
CID 102466469

Frequently Asked Questions

What is the IUPAC name of 9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one?
The IUPAC name of 9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one (CID 146162479) is 9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one.
What is the SMILES notation for 9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one?
The canonical SMILES for 9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one is COC12OC(c3ccccc3)CC1=CC(=O)c1ccccc12.
What is the InChIKey of 9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one?
The InChIKey is PUDRMTKOBOLUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16O3/c1-21-19-14(11-17(20)15-9-5-6-10-16(15)19)12-18(22-19)13-7-3-2-4-8-13/h2-11,18H,12H2,1H3.
What are the key properties of 9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one?
9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one has a molecular weight of 292.33 g/mol, XLogP of 3.77, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9b-methoxy-2-phenyl-2,3-dihydrobenzo[g][1]benzofuran-5-one is sourced from PubChem (CID 146162479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).