Cas no 58698-68-3 (2-Propenoic acid, 2-methyl-, 2-(2,2-dimethyl-1-oxopropoxy)ethyl ester)
58698-68-3 structure
Product Name:2-Propenoic acid, 2-methyl-, 2-(2,2-dimethyl-1-oxopropoxy)ethyl ester
CAS No:58698-68-3
MF:C11H18O4
MW:214.258224010468
CID:341195
PubChem ID:20466164
Update Time:2025-04-19
2-Propenoic acid, 2-methyl-, 2-(2,2-dimethyl-1-oxopropoxy)ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 2-methyl-, 2-(2,2-dimethyl-1-oxopropoxy)ethyl ester
- 2-(2-methylprop-2-enoyloxy)ethyl 2,2-dimethylpropanoate
- DTXSID90607527
- SCHEMBL11106417
- 2-[(2,2-Dimethylpropanoyl)oxy]ethyl 2-methylprop-2-enoate
- 58698-68-3
-
- Inchi： 1S/C11H18O4/c1-8(2)9(12)14-6-7-15-10(13)11(3,4)5/h1,6-7H2,2-5H3
- InChI Key： WYYSTKNOBMCNQX-UHFFFAOYSA-N
- SMILES： O(CCOC(C(=C)C)=O)C(C(C)(C)C)=O
Computed Properties
- Exact Mass: 214.12054
- Monoisotopic Mass: 214.12050905g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 7
- Complexity: 260
- 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: 2.4
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
2-Propenoic acid, 2-methyl-, 2-(2,2-dimethyl-1-oxopropoxy)ethyl ester Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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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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