Cas no 33318-74-0 (Oxazole, 5-ethyl-2,4-dimethyl-)
33318-74-0 structure
Product Name:Oxazole, 5-ethyl-2,4-dimethyl-
CAS No:33318-74-0
MF:C7H11NO
MW:125.168341875076
CID:1456374
PubChem ID:525776
Update Time:2025-04-20
Oxazole, 5-ethyl-2,4-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Oxazole, 5-ethyl-2,4-dimethyl-
- DTXSID901309991
- 5-ethyl-2,4-dimethyl-oxazole
- Oxazole, 2,4-dimethyl-5-ethyl
- 5-ethyl-2,4-dimethyl-1,3-oxazole
- XOOCKFZHDAFKNK-UHFFFAOYSA-N
- A955655SUV
- 5-Ethyl-2,4-dimethyloxazole
- 2,4-dimethyl-5-ethyloxazole
- 33318-74-0
- CHEBI:193628
- SCHEMBL961927
-
- Inchi： 1S/C7H11NO/c1-4-7-5(2)8-6(3)9-7/h4H2,1-3H3
- InChI Key： XOOCKFZHDAFKNK-UHFFFAOYSA-N
- SMILES： O1C(C)=NC(C)=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: 1
- Complexity: 94.9
- 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, 5-ethyl-2,4-dimethyl- Related Literature
-
Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
-
Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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