Cas no 876503-22-9 (6,7-dihydro-5H-1,3-Dioxolo[4,5-f]isoindole)
876503-22-9 structure
Product Name:6,7-dihydro-5H-1,3-Dioxolo[4,5-f]isoindole
CAS No:876503-22-9
MF:C9H9NO2
MW:163.173262357712
CID:1120204
PubChem ID:17804790
Update Time:2025-04-20
6,7-dihydro-5H-1,3-Dioxolo[4,5-f]isoindole Chemical and Physical Properties
Names and Identifiers
-
- 6,7-dihydro-5H-1,3-Dioxolo[4,5-f]isoindole
- 5H-?1,?3-?Dioxolo[4,?5-?f]?isoindole, 6,?7-?dihydro-
- SCHEMBL4689086
- 876503-22-9
- SCHEMBL4689092
- 6,7-dihydro-5H-[1,3]dioxolo[4,5-f]isoindole
- DB-383068
-
- Inchi: 1S/C9H9NO2/c1-6-3-10-4-7(6)2-9-8(1)11-5-12-9/h1-2,10H,3-5H2
- InChI Key: LQOCMFGDZDNZAI-UHFFFAOYSA-N
- SMILES: O1COC2C1=CC1CNCC=1C=2
Computed Properties
- Exact Mass: 163.063328530g/mol
- Monoisotopic Mass: 163.063328530g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 167
- 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: 0.7
- Topological Polar Surface Area: 30.5?2
6,7-dihydro-5H-1,3-Dioxolo[4,5-f]isoindole 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
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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