Cas no 87802-96-8 (Propanedioic acid, [1-(1-methylethyl)-2-propenyl]-, dimethyl ester)
87802-96-8 structure
Product Name:Propanedioic acid, [1-(1-methylethyl)-2-propenyl]-, dimethyl ester
CAS No:87802-96-8
MF:C11H18O4
MW:214.258224010468
CID:652186
PubChem ID:71412085
Update Time:2025-04-19
Propanedioic acid, [1-(1-methylethyl)-2-propenyl]-, dimethyl ester Chemical and Physical Properties
Names and Identifiers
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- Propanedioic acid, [1-(1-methylethyl)-2-propenyl]-, dimethyl ester
- dimethyl 2-(4-methylpent-1-en-3-yl)propanedioate
- Dimethyl (4-methylpent-1-en-3-yl)propanedioate
- 87802-96-8
- DTXSID80831657
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- Inchi: 1S/C11H18O4/c1-6-8(7(2)3)9(10(12)14-4)11(13)15-5/h6-9H,1H2,2-5H3
- InChI Key: VVTRDOQIOTVTDJ-UHFFFAOYSA-N
- SMILES: O(C)C(C(C(=O)OC)C(C=C)C(C)C)=O
Computed Properties
- Exact Mass: 214.12050905g/mol
- 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: 229
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 52.6?2
Propanedioic acid, [1-(1-methylethyl)-2-propenyl]-, dimethyl ester Related Literature
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1. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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2. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Mei-Yu Xu,Ya-Ting Wang,Qing-Ling Ni,Zi-Hao Zhang,Guang-Ming Liang,Liu-Cheng Gui Dalton Trans., 2016,45, 4993-4997
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