Cas no 31299-91-9 (Thiazole,2-chloro-5-(2-chloroethyl)-4-methyl-)
31299-91-9 structure
Product Name:Thiazole,2-chloro-5-(2-chloroethyl)-4-methyl-
CAS No:31299-91-9
MF:C6H7Cl2NS
MW:196.097478151321
CID:315005
PubChem ID:207964
Update Time:2025-04-19
Thiazole,2-chloro-5-(2-chloroethyl)-4-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Thiazole,2-chloro-5-(2-chloroethyl)-4-methyl-
- 2-chloro-5-(2-chloroethyl)-4-methyl-1,3-thiazole
- QOCBYUYXAYWNIW-UHFFFAOYSA-N
- 31299-91-9
- DTXSID70185217
- 2-chloro-4-methyl-5-(2-chloroethyl)-thiazole
- SCHEMBL8931356
- BRN 1101189
- 2-chloro-4-methyl-5-(2-chloroethyl)thiazole
- 2-Chloro-5-(2-chloroethyl)-4-methylthiazole
- Thiazole, 2-chloro-5-(2-chloroethyl)-4-methyl-
-
- Inchi： 1S/C6H7Cl2NS/c1-4-5(2-3-7)10-6(8)9-4/h2-3H2,1H3
- InChI Key： QOCBYUYXAYWNIW-UHFFFAOYSA-N
- SMILES： ClCCC1=C(C)N=C(S1)Cl
Computed Properties
- Exact Mass: 194.96781
- Monoisotopic Mass: 194.968
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 112
- 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: 3.2
- Topological Polar Surface Area: 41.1?2
Experimental Properties
- Density: 1.356
- Boiling Point: 301.2°Cat760mmHg
- Flash Point: 135.9°C
- Refractive Index: 1.561
- PSA: 12.89
Thiazole,2-chloro-5-(2-chloroethyl)-4-methyl- Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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