Cas no 126235-11-8 (Thieno[3,4-b]-1,4-dioxin,2,3-dihydro-2-methyl-)
126235-11-8 structure
Product Name:Thieno[3,4-b]-1,4-dioxin,2,3-dihydro-2-methyl-
CAS No:126235-11-8
MF:C7H8O2S
MW:156.202220916748
CID:2654492
PubChem ID:12128760
Update Time:2025-04-21
Thieno[3,4-b]-1,4-dioxin,2,3-dihydro-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 3-methyl-2,3-dihydrothieno[3,4-b][1,4]dioxine
- SCHEMBL181922
- Thieno[3,4-b]-1,4-dioxin,2,3-dihydro-2-methyl-
- AKOS015842794
- 2-methyl-2,3-dihydro-thieno[3,4-b][1,4]dioxine
- Racemic 2-methyl-2,3-dihydro-thieno[3,4-b] [1,4]dioxine
- Racemic 2-methyl-2,3-dihydro-thieno[3,4-b][1,4]dioxine
- 2-methyl-2,3-dihydrothieno[3,4-b][1,4]dioxine
- DTXSID70478136
- 150504-14-6
- DTXSID401279137
- 2-methyl-2,3-dihydro-thieno[3,4-b] [1,4]dioxine
- 126235-11-8
-
- Inchi: 1S/C7H8O2S/c1-5-2-8-6-3-10-4-7(6)9-5/h3-5H,2H2,1H3
- InChI Key: MXLYDTCSOHXFFA-UHFFFAOYSA-N
- SMILES: S1C=C2C(=C1)OC(C)CO2
Computed Properties
- Exact Mass: 156.02450067Da
- Monoisotopic Mass: 156.02450067Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 129
- 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
- XLogP3: 1.8
- Topological Polar Surface Area: 46.7?2
Experimental Properties
- Density: 1.222±0.06 g/cm3(Predicted)
- Boiling Point: 216.5±19.0 °C(Predicted)
Thieno[3,4-b]-1,4-dioxin,2,3-dihydro-2-methyl- Related Literature
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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