Cas no 40953-14-8 (Oxazole, 2,5-diethyl-)
Oxazole, 2,5-diethyl- structure
Product Name:Oxazole, 2,5-diethyl-
CAS No:40953-14-8
MF:C7H11NO
MW:125.168341875076
CID:332767
PubChem ID:3016237
Update Time:2025-04-19
Oxazole, 2,5-diethyl- Chemical and Physical Properties
Names and Identifiers
-
- Oxazole, 2,5-diethyl-
- 2,5-diethyloxazole
- 2,5-diethyl-1,3-oxazole
- DTXSID90193955
- 40953-14-8
- SCHEMBL3265214
- IQWHXRKZJXFLTB-UHFFFAOYSA-N
- EINECS 255-160-6
- Oxazole, 2,5-diethyl
- JM3AWP3V9A
- NS00056014
-
- Inchi： 1S/C7H11NO/c1-3-6-5-8-7(4-2)9-6/h5H,3-4H2,1-2H3
- InChI Key： IQWHXRKZJXFLTB-UHFFFAOYSA-N
- SMILES： O1C(CC)=NC=C1CC
Computed Properties
- Exact Mass: 125.08413
- Monoisotopic Mass: 125.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 85
- 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
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 26.03
Oxazole, 2,5-diethyl- Related Literature
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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