Cas no 651059-72-2 (Oxazole, 2,4-dimethyl-5-(4-methylphenyl)-)
651059-72-2 structure
Product Name:Oxazole, 2,4-dimethyl-5-(4-methylphenyl)-
CAS No:651059-72-2
MF:C12H13NO
MW:187.237723112106
CID:406849
PubChem ID:53887413
Update Time:2025-04-19
Oxazole, 2,4-dimethyl-5-(4-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Oxazole, 2,4-dimethyl-5-(4-methylphenyl)-
- 2,4-dimethyl-5-(4-methylphenyl)-1,3-oxazole
- 651059-72-2
- DTXSID90707415
- SCHEMBL8192267
-
- Inchi： 1S/C12H13NO/c1-8-4-6-11(7-5-8)12-9(2)13-10(3)14-12/h4-7H,1-3H3
- InChI Key： HOCXGNPZEFVHFC-UHFFFAOYSA-N
- SMILES： O1C(C)=NC(C)=C1C1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 187.09979
- Monoisotopic Mass: 187.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 187
- 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: 26?2
Experimental Properties
- PSA: 26.03
Oxazole, 2,4-dimethyl-5-(4-methylphenyl)- Related Literature
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
651059-72-2 (Oxazole, 2,4-dimethyl-5-(4-methylphenyl)-) Related Products
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