Cas no 602330-89-2 (Thiazole, 2-isocyanato-4,5-dimethyl-)
602330-89-2 structure
Product Name:Thiazole, 2-isocyanato-4,5-dimethyl-
CAS No:602330-89-2
MF:C6H6N2OS
MW:154.189639568329
CID:4059711
PubChem ID:23062273
Update Time:2025-04-22
Thiazole, 2-isocyanato-4,5-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Thiazole, 2-isocyanato-4,5-dimethyl-
- 4,5-Dimethylthiazole-2-yl isocyanate
- 602330-89-2
- SCHEMBL6311583
- BDCRRSIQQVWEKI-UHFFFAOYSA-N
- 2-Isocyanato-4,5-dimethylthiazole
-
- Inchi： 1S/C6H6N2OS/c1-4-5(2)10-6(8-4)7-3-9/h1-2H3
- InChI Key： BDCRRSIQQVWEKI-UHFFFAOYSA-N
- SMILES： S1C(C)=C(C)N=C1N=C=O
Computed Properties
- Exact Mass: 154.02008399Da
- Monoisotopic Mass: 154.02008399Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 167
- 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: 2.9
- Topological Polar Surface Area: 70.6?2
Thiazole, 2-isocyanato-4,5-dimethyl- Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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