Cas no 52414-87-6 (4-methyl-2-propyl-1,3-thiazole)
52414-87-6 structure
Product Name:4-methyl-2-propyl-1,3-thiazole
CAS No:52414-87-6
MF:C7H11NS
MW:141.23394036293
CID:1577229
PubChem ID:521382
Update Time:2025-04-21
4-methyl-2-propyl-1,3-thiazole Chemical and Physical Properties
Names and Identifiers
-
- 4-methyl-2-propyl-1,3-thiazole
- 2-Propyl-4-methylthiazole
- 4-METHYL-2-PROPYLTHIAZOLE
- thiazole, 4-methyl-2-propyl-
- Q63395694
- 4-Methyl-2-propyl-1,3-thiazole #
- DB-306027
- DTXSID901311912
- SCHEMBL129530
- AKOS026732166
- 52414-87-6
-
- Inchi: 1S/C7H11NS/c1-3-4-7-8-6(2)5-9-7/h5H,3-4H2,1-2H3
- InChI Key: WUISKNCHCVXERE-UHFFFAOYSA-N
- SMILES: S1C=C(C)N=C1CCC
Computed Properties
- Exact Mass: 141.06133
- Monoisotopic Mass: 141.06122053g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 85
- 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: 2.5
- Topological Polar Surface Area: 41.1?2
Experimental Properties
- PSA: 12.89
4-methyl-2-propyl-1,3-thiazole Related Literature
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
52414-87-6 (4-methyl-2-propyl-1,3-thiazole) Related Products
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