Cas no 3377-21-7 (Propanedioic acid,2-methylene-, 1,3-dimethyl ester)
3377-21-7 structure
Product Name:Propanedioic acid,2-methylene-, 1,3-dimethyl ester
Propanedioic acid,2-methylene-, 1,3-dimethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic acid,2-methylene-, 1,3-dimethyl ester
- dimethyl 2-methylidenepropanedioate
- DIMETHYL METHYLENEMALONATE
- dimethyl methylidenepropanedioate
- 1,3-DIMETHYL 2-METHYLIDENEPROPANEDIOATE
- 2-METHYLENE DIMETHYL MALONATE
- YQN34UG3PK
- DTXSID30187434
- Methylenemalonic acid, dimethyl ester
- Dimethyl 2-methylenemalonate #
- SCHEMBL40660
- 3377-21-7
- dimethyl methlenemalonate
- Dimethyl2-methylenemalonate
- Methylenmalonsauredimethylester
- Propanedioic acid, methylene-, dimethyl ester
- NS00029543
- Dimethyl 2-methylenemalonate
- UNII-YQN34UG3PK
- AKOS015917407
- Propanedioic acid, 2-methylene-, 1,3-dimethyl ester
- EINECS 222-171-2
-
- Inchi： 1S/C6H8O4/c1-4(5(7)9-2)6(8)10-3/h1H2,2-3H3
- InChI Key： KTLZQSZGORXBED-UHFFFAOYSA-N
- SMILES： O(C)C(C(=C)C(=O)OC)=O
Computed Properties
- Exact Mass: 144.04224
- Monoisotopic Mass: 144.04225873g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 153
- 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: 0.8
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
Propanedioic acid,2-methylene-, 1,3-dimethyl ester Related Literature
-
Rishab N. Iyer,David Favela,Guoliang Zhang,David E. Olson Nat. Prod. Rep. 2021 38 307
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2. Structural characterization of (±)-N-chloro-2,2-bis(methoxycarbonyl)aziridine by X-ray crystallography and 2D NMR spectroscopyL. Antolini,A. Forni,I. Moretti,L. Schenetti,F. Prati J. Chem. Soc. Perkin Trans. 2 1992 1541
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3. Metal-assisted cycloadditions. Part 3. Reactions of dicarbonyl(η5-cyclopentadienyl)(η1-2-methoxyallyl)iron with electron-deficient olefins and acetylenesTrevor S. Abram,Raymond Baker,Christopher M. Exon,V. Bhaskar Rao,Ralph W. Turner J. Chem. Soc. Perkin Trans. 1 1982 301
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4. Anodic oxidation. Part VIII. Electrolysis of dimethyl sodiomalonate in hexamethylphosphoric triamideR. Brettle,D. Seddon J. Chem. Soc. C 1970 1153
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5. Metal-assisted cycloadditions. Part 1. Synthesis of substituted cyclopentane-derivatives obtained from the reactions of (η1-allyl)dicarbonyl(η5-cyclopentadienyl)iron with electron-deficient olefins and acetylenesTrevor S. Abram,Raymond Baker,Christopher M. Exon,V. Bhaskar Rao J. Chem. Soc. Perkin Trans. 1 1982 285
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