Cas no 686753-00-4 (Oxazole, 2-(3,5-dimethylphenyl)-4,5-dihydro-)
686753-00-4 structure
Product Name:Oxazole, 2-(3,5-dimethylphenyl)-4,5-dihydro-
CAS No:686753-00-4
MF:C11H13NO
MW:175.227022886276
CID:392759
PubChem ID:71374562
Update Time:2025-04-19
Oxazole, 2-(3,5-dimethylphenyl)-4,5-dihydro- Chemical and Physical Properties
Names and Identifiers
-
- Oxazole, 2-(3,5-dimethylphenyl)-4,5-dihydro-
- 2-(3,5-dimethylphenyl)-4,5-dihydro-1,3-oxazole
- DTXSID10797338
- 686753-00-4
-
- Inchi： 1S/C11H13NO/c1-8-5-9(2)7-10(6-8)11-12-3-4-13-11/h5-7H,3-4H2,1-2H3
- InChI Key： VHIWYCUMPDFPOH-UHFFFAOYSA-N
- SMILES： O1CCN=C1C1C=C(C)C=C(C)C=1
Computed Properties
- Exact Mass: 175.09979
- Monoisotopic Mass: 175.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 202
- 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: 2.2
- Topological Polar Surface Area: 21.6?2
Experimental Properties
- PSA: 21.59
Oxazole, 2-(3,5-dimethylphenyl)-4,5-dihydro- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
686753-00-4 (Oxazole, 2-(3,5-dimethylphenyl)-4,5-dihydro-) Related Products
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