- Enantioselective addition of arylboronic acids to methyl 2-formylbenzoates by using a ruthenium/Me-BIPAM catalyst for synthesis of chiral 3-aryl-isobenzofuranonesYohda, Masaaki; Yamamoto, Yasunori, Organic & Biomolecular Chemistry, 2015, 13(44), 10874-10880
Cas no 922169-96-8 (1(3H)-Isobenzofuranone, 5,7-dimethoxy-3-(4-methoxyphenyl)-)
1(3H)-Isobenzofuranone, 5,7-dimethoxy-3-(4-methoxyphenyl)- is a synthetic organic compound featuring a substituted isobenzofuranone core. Its structure incorporates methoxy groups at the 5,7-positions and a 4-methoxyphenyl moiety at the 3-position, enhancing its stability and potential reactivity in synthetic applications. This compound is of interest in pharmaceutical and materials research due to its rigid aromatic framework and electron-rich substituents, which may facilitate interactions in catalytic or binding processes. Its well-defined molecular architecture makes it a valuable intermediate for constructing complex heterocyclic systems. The compound’s purity and structural consistency are critical for reproducibility in experimental studies.
922169-96-8 structure
Product Name:1(3H)-Isobenzofuranone, 5,7-dimethoxy-3-(4-methoxyphenyl)-
CAS No:922169-96-8
MF:C17H16O5
MW:300.305945396423
CID:741795
PubChem ID:44430503
Update Time:2025-10-29
1(3H)-Isobenzofuranone, 5,7-dimethoxy-3-(4-methoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1(3H)-Isobenzofuranone, 5,7-dimethoxy-3-(4-methoxyphenyl)-
- 5,6-Desmethylenedioxy-5-methoxyaglalactone
- 5,7-dimethoxy-3-(4-methoxyphenyl)-3H-2-benzofuran-1-one
- (-)-5,7-Dimethoxy-3-(4-methoxyphenyl)-1(3H)-isobenzofuranone (ACI)
- starbld0002770
- 5,7-dimethoxy-3-(4-methoxyphenyl)isobenzofuran-1(3H)-one
- AKOS040762845
- 922169-96-8
- DTXSID30659060
- 5,7-Dimethoxy-3-(4-methoxyphenyl)-2-benzofuran-1(3H)-one
- CHEMBL233039
-
- Inchi： 1S/C17H16O5/c1-19-11-6-4-10(5-7-11)16-13-8-12(20-2)9-14(21-3)15(13)17(18)22-16/h4-9,16H,1-3H3
- InChI Key： YNGUFTHOYVRQDO-UHFFFAOYSA-N
- SMILES： O(C1C=C(OC)C=C2C(C3C=CC(OC)=CC=3)OC(C=12)=O)C
Computed Properties
- Exact Mass: 300.1
- Monoisotopic Mass: 300.1
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 391
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 54A^2
- XLogP3: 3
Experimental Properties
- Color/Form: Powder
1(3H)-Isobenzofuranone, 5,7-dimethoxy-3-(4-methoxyphenyl)- Security Information
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：Store at 4 ℃, better at -4 ℃
1(3H)-Isobenzofuranone, 5,7-dimethoxy-3-(4-methoxyphenyl)- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI TAO SHU Biotechnology Co., Ltd. | TN5684-5 mg |
5,6-Desmethylenedioxy-5-methoxyaglalactone |
922169-96-8 | 5mg |
￥6415.00 | 2022-04-26 | ||
| TargetMol Chemicals | TN5684-5mg |
5,6-Desmethylenedioxy-5-methoxyaglalactone |
922169-96-8 | 5mg |
￥ 4750 | 2024-07-20 | ||
| TargetMol Chemicals | TN5684-5 mg |
5,6-Desmethylenedioxy-5-methoxyaglalactone |
922169-96-8 | 98% | 5mg |
￥ 4,750 | 2023-07-11 | |
| TargetMol Chemicals | TN5684-1 mL * 10 mM (in DMSO) |
5,6-Desmethylenedioxy-5-methoxyaglalactone |
922169-96-8 | 98% | 1 mL * 10 mM (in DMSO) |
￥ 4850 | 2023-09-15 | |
| TargetMol Chemicals | TN5684-1 ml * 10 mm |
5,6-Desmethylenedioxy-5-methoxyaglalactone |
922169-96-8 | 1 ml * 10 mm |
￥ 4850 | 2024-07-20 | ||
| TargetMol Chemicals | TN5684-5mg |
5,6-Desmethylenedioxy-5-methoxyaglalactone |
922169-96-8 | 5mg |
￥ 4750 | 2024-07-24 | ||
| TargetMol Chemicals | TN5684-1 ml * 10 mm |
5,6-Desmethylenedioxy-5-methoxyaglalactone |
922169-96-8 | 1 ml * 10 mm |
￥ 4850 | 2024-07-24 |
1(3H)-Isobenzofuranone, 5,7-dimethoxy-3-(4-methoxyphenyl)- Production Method
Production Method 1
Reaction Conditions
1.1 Catalysts: Bis(dichloro(η6-p-cymene)ruthenium) , (11bR,11′bR)-2,2′-[Oxybis(methylene)]bis[N,N-dimethyldinaphtho[2,1-d:1′,2′-f][1,… Solvents: Toluene ; 30 min, rt
1.2 Reagents: Potassium carbonate Solvents: Water ; 18 h, rt
1.3 Reagents: Ammonium chloride Solvents: Water
1.2 Reagents: Potassium carbonate Solvents: Water ; 18 h, rt
1.3 Reagents: Ammonium chloride Solvents: Water
Reference
1(3H)-Isobenzofuranone, 5,7-dimethoxy-3-(4-methoxyphenyl)- Raw materials
1(3H)-Isobenzofuranone, 5,7-dimethoxy-3-(4-methoxyphenyl)- Preparation Products
1(3H)-Isobenzofuranone, 5,7-dimethoxy-3-(4-methoxyphenyl)- Related Literature
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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