Cas no 63317-78-2 (1,3-Isobenzofurandione, 5,5'-(1,1,6,6-tetramethyl-1,6-hexanediyl)bis-)
63317-78-2 structure
Product Name:1,3-Isobenzofurandione, 5,5'-(1,1,6,6-tetramethyl-1,6-hexanediyl)bis-
CAS No:63317-78-2
MF:C26H26O6
MW:434.481048107147
CID:390218
PubChem ID:605203
Update Time:2025-04-19
1,3-Isobenzofurandione, 5,5'-(1,1,6,6-tetramethyl-1,6-hexanediyl)bis- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Isobenzofurandione, 5,5'-(1,1,6,6-tetramethyl-1,6-hexanediyl)bis-
- 5,5'-(2,7-Dimethyloctane-2,7-diyl)bis(isobenzofuran-1,3-dione)
- 5-[7-(1,3-dioxo-2-benzofuran-5-yl)-2,7-dimethyloctan-2-yl]-2-benzofuran-1,3-dione
- 63317-78-2
- MSXVZKRMNCGMER-UHFFFAOYSA-N
- DTXSID00345524
-
- Inchi： 1S/C26H26O6/c1-25(2,15-7-9-17-19(13-15)23(29)31-21(17)27)11-5-6-12-26(3,4)16-8-10-18-20(14-16)24(30)32-22(18)28/h7-10,13-14H,5-6,11-12H2,1-4H3
- InChI Key： MSXVZKRMNCGMER-UHFFFAOYSA-N
- SMILES： O1C(C2=CC=C(C=C2C1=O)C(C)(C)CCCCC(C)(C)C1=CC=C2C(=O)OC(C2=C1)=O)=O
Computed Properties
- Exact Mass: 434.17293854g/mol
- Monoisotopic Mass: 434.17293854g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 32
- Rotatable Bond Count: 7
- Complexity: 730
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 6.8
- Topological Polar Surface Area: 86.7?2
1,3-Isobenzofurandione, 5,5'-(1,1,6,6-tetramethyl-1,6-hexanediyl)bis- Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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