Cas no 59020-78-9 (2-Thiazolemethanol, a-ethenyl-4-methyl-)
59020-78-9 structure
Product Name:2-Thiazolemethanol, a-ethenyl-4-methyl-
CAS No:59020-78-9
MF:C7H9NOS
MW:155.217460393906
CID:340151
Update Time:2024-01-28
2-Thiazolemethanol, a-ethenyl-4-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Thiazolemethanol, a-ethenyl-4-methyl-
- 1-(4-methylthiazol-2-yl)prop-2-en-1-ol
- 2-Thiazolemethanol, α-ethenyl-4-methyl-
- α-Ethenyl-4-methyl-2-thiazolemethanol
-
- Inchi： 1S/C7H9NOS/c1-3-6(9)7-8-5(2)4-10-7/h3-4,6,9H,1H2,2H3
- InChI Key： AQNRULLGNILZFO-UHFFFAOYSA-N
- SMILES： C(C1SC=C(C)N=1)(O)C=C
Computed Properties
- Exact Mass: 155.04
- Monoisotopic Mass: 155.04
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- 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
- Topological Polar Surface Area: 61.4A^2
Experimental Properties
- Density: 1.184±0.06 g/cm3(Predicted)
- Boiling Point: 240.0±35.0 °C(Predicted)
- pka: 12.26±0.20(Predicted)
2-Thiazolemethanol, a-ethenyl-4-methyl- Related Literature
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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5. 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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