Cas no 126533-86-6 (4-Thiazolecarboxaldehyde, 2-(ethylamino)-)
126533-86-6 structure
Product Name:4-Thiazolecarboxaldehyde, 2-(ethylamino)-
CAS No:126533-86-6
MF:C6H8N2OS
MW:156.205519676208
CID:897300
Update Time:2025-04-19
4-Thiazolecarboxaldehyde, 2-(ethylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 4-Thiazolecarboxaldehyde, 2-(ethylamino)-
- 2-(ethylamino)-1,3-thiazole-4-carbaldehyde
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- Inchi： 1S/C6H8N2OS/c1-2-7-6-8-5(3-9)4-10-6/h3-4H,2H2,1H3,(H,7,8)
- InChI Key： HBZUFCWQTXLKOB-UHFFFAOYSA-N
- SMILES： S1C=C(C=O)N=C1NCC
Computed Properties
- Exact Mass: 156.03584
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 15
- Hydrogen Bond Acceptor Count: 15
- Heavy Atom Count: 86
- Rotatable Bond Count: 32
- Complexity: 2340
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 10
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 1000
- XLogP3: nothing
Experimental Properties
- PSA: 41.99
4-Thiazolecarboxaldehyde, 2-(ethylamino)- Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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3. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
126533-86-6 (4-Thiazolecarboxaldehyde, 2-(ethylamino)-) Related Products
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