2,2-Dimethyl-3-butenoic Acid Ethyl Ester - CAS 58544-20-0

Catalog: BB067153
Product Name: 2,2-Dimethyl-3-butenoic Acid Ethyl Ester
CAS: 58544-20-0
Synonyms: Ethyl 2,2-Dimethyl-3-butenoate; NSC 402036
2,2-Dimethyl-3-butenoic Acid Ethyl Ester
IUPAC Name:ethyl 2,2-dimethylbut-3-enoate
Description:2,2-Dimethyl-3-butenoic Acid Ethyl Ester is the ethyl ester of 2,2-Dimethyl-3-butenoic Acid (D469055) which is an constituent in the synthesis of metabolites of Simvastatin (S485000), a synthetic derivative of a fermentation product of Aspergillus terreus.
Molecular Weight:142.2
Molecular Formula:C8H14O2
Canonical SMILES:CCOC(=O)C(C)(C)C=C
InChI:InChI=1S/C8H14O2/c1-5-8(3,4)7(9)10-6-2/h5H,1,6H2,2-4H3
InChI Key:QXPBUEMBEQQXKU-UHFFFAOYSA-N
References:Hoffman, W.F., et al. J. Med. Chem., 29, 849 (1986), Mol, M.J., et al. Lancet, 2, 936 (1986).

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