Cas no 1237745-94-6 (4-Trifluoromethyl-thiazole-2-carbonyl chloride)
1237745-94-6 structure
Product Name:4-Trifluoromethyl-thiazole-2-carbonyl chloride
CAS No:1237745-94-6
MF:C5HClF3NOS
MW:215.5807492733
CID:2130483
Update Time:2023-08-04
4-Trifluoromethyl-thiazole-2-carbonyl chloride Chemical and Physical Properties
Names and Identifiers
-
- 4-trifluoromethyl-thiazole-2-carbonyl chloride
- RDWWDSAWZFICKL-UHFFFAOYSA-N
- 2-Thiazolecarbonyl chloride, 4-(trifluoromethyl)-
- 4-Trifluoromethyl-thiazole-2-carbonyl chloride
-
- Inchi: 1S/C5HClF3NOS/c6-3(11)4-10-2(1-12-4)5(7,8)9/h1H
- InChI Key: RDWWDSAWZFICKL-UHFFFAOYSA-N
- SMILES: ClC(C1=NC(=CS1)C(F)(F)F)=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 198
- Topological Polar Surface Area: 58.2
4-Trifluoromethyl-thiazole-2-carbonyl chloride Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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