Cas no 82324-04-7 (Thiireno[e]-1,3-benzodioxole(9CI))
![Thiireno[e]-1,3-benzodioxole(9CI) structure](https://ossimg.kuujia.com/scimg/82500/82324-04-7x500.png)
82324-04-7 structure
Product Name:Thiireno[e]-1,3-benzodioxole(9CI)
CAS No:82324-04-7
MF:C7H4O2S
MW:152.170460700989
CID:708345
PubChem ID:57353760
Update Time:2025-04-19
Thiireno[e]-1,3-benzodioxole(9CI) Chemical and Physical Properties
Names and Identifiers
-
- Thiireno[e]-1,3-benzodioxole(9CI)
- thiireno[2,3-g][1,3]benzodioxole
- 2H-Thiireno[e][1,3]benzodioxole
- DTXSID40722592
- 82324-04-7
-
- Inchi： 1S/C7H4O2S/c1-2-5-7(10-5)6-4(1)8-3-9-6/h1-2H,3H2
- InChI Key： IITGLJLWLJEMOS-UHFFFAOYSA-N
- SMILES： S1C2=CC=C3C(=C12)OCO3
Computed Properties
- Exact Mass: 151.99320054g/mol
- Monoisotopic Mass: 151.99320054g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 162
- 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: 1.2
- Topological Polar Surface Area: 43.8?2
Thiireno[e]-1,3-benzodioxole(9CI) Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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