Cas no 89612-19-1 (1,2,4-Oxadiazole, 3-(2,6-dimethylphenyl)-5-methyl-)
89612-19-1 structure
Product Name:1,2,4-Oxadiazole, 3-(2,6-dimethylphenyl)-5-methyl-
CAS No:89612-19-1
MF:C11H12N2O
MW:188.225782394409
CID:594790
PubChem ID:13237461
Update Time:2025-04-19
1,2,4-Oxadiazole, 3-(2,6-dimethylphenyl)-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,2,4-Oxadiazole, 3-(2,6-dimethylphenyl)-5-methyl-
- 3-(2,6-dimethylphenyl)-5-methyl-1,2,4-oxadiazole
- 89612-19-1
- DTXSID10530969
-
- Inchi： 1S/C11H12N2O/c1-7-5-4-6-8(2)10(7)11-12-9(3)14-13-11/h4-6H,1-3H3
- InChI Key： ZVZSNSCYWDNFDF-UHFFFAOYSA-N
- SMILES： O1C(C)=NC(C2C(C)=CC=CC=2C)=N1
Computed Properties
- Exact Mass: 188.094963011g/mol
- Monoisotopic Mass: 188.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 188
- 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: 3.1
- Topological Polar Surface Area: 38.9?2
1,2,4-Oxadiazole, 3-(2,6-dimethylphenyl)-5-methyl- Related Literature
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1. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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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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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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