Diethyl 2-(3-buten-1-yl)-2-methylmalonate - CAS 5331-70-4

Catalog: BB068389
Product Name: Diethyl 2-(3-buten-1-yl)-2-methylmalonate
CAS: 5331-70-4
Synonyms: 1,3-Diethyl 2-(3-buten-1-yl)-2-methylpropanedioate; NSC 2318
Diethyl 2-(3-buten-1-yl)-2-methylmalonate
IUPAC Name:diethyl 2-but-3-enyl-2-methylpropanedioate
Description:Diethyl 2-(3-buten-1-yl)-2-methylmalonate is an intermediate in the synthesis of trans-1,3-Dimethylcyclopentane (~70%) (D464915) which is one of the products after the biodegradation of crude oil.
Molecular Weight:228.29
Molecular Formula:C12H20O4
Canonical SMILES:CCOC(=O)C(C)(CCC=C)C(=O)OCC
InChI:InChI=1S/C12H20O4/c1-5-8-9-12(4,10(13)15-6-2)11(14)16-7-3/h5H,1,6-9H2,2-4H3
InChI Key:FXXKYZMPONDNNT-UHFFFAOYSA-N
References:Elias, R., et. al: Org. Geochem., 38,2111 (2007).

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