Cas no 5373-86-4 (3-(4-Methylphenyl)-5-(trichloromethyl)-1,2,4-oxadiazole)
5373-86-4 structure
Product Name:3-(4-Methylphenyl)-5-(trichloromethyl)-1,2,4-oxadiazole
CAS No:5373-86-4
MF:C10H7Cl3N2O
MW:277.534379243851
CID:45782
PubChem ID:563809
Update Time:2025-04-18
3-(4-Methylphenyl)-5-(trichloromethyl)-1,2,4-oxadiazole Chemical and Physical Properties
Names and Identifiers
-
- 3-(4-Methylphenyl)-5-(trichloromethyl)-1,2,4-oxadiazole
- 3-p-toly-5-(trichloromethyl)-1,2,4-oxadiazole
- DTXSID20340339
- 3-(p-tolyl)-5-(trichloromethyl)-1,2,4-oxadiazole
- 3-[p-Tolyl]-5-trichloromethyl-1,2,4-oxadiazole
- 3-(4-Methylphenyl)-5-(trichloromethyl)-1,2,4-oxadiazole, AldrichCPR
- SCHEMBL4227737
- 3-(4-Methylphenyl)-5-(trichloromethyl)-1,2,4-oxadiazole #
- 5373-86-4
- AMY18054
-
- Inchi： 1S/C10H7Cl3N2O/c1-6-2-4-7(5-3-6)8-14-9(16-15-8)10(11,12)13/h2-5H,1H3
- InChI Key： VBPKDZSGMVLXEN-UHFFFAOYSA-N
- SMILES： ClC(C1=NC(C2C=CC(C)=CC=2)=NO1)(Cl)Cl
Computed Properties
- Exact Mass: 275.96261
- Monoisotopic Mass: 275.962396g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 239
- 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: 4
- Topological Polar Surface Area: 38.9?2
Experimental Properties
- Density: 1.448
- PSA: 38.92
3-(4-Methylphenyl)-5-(trichloromethyl)-1,2,4-oxadiazole Related Literature
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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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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