50780-99-9

Basic information

• Product Name: diisobutyl malonate
• Synonyms: diisobutyl malonate;Malonsurediisobutylester;Ai3-33814;Einecs 256-759-5;Propanedioic acid, bis(2-methylpropyl) ester
• CAS NO: 50780-99-9
• Molecular Formula: C₁₁H₂₀O₄
• Molecular Weight: 216.2741
• EINECS: 256-759-5
• Mol File: 50780-99-9.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 237.8°C at 760 mmHg
• Flash Point: 103.1°C
• Appearance: /
• Density: 0.992g/cm³
• Vapor Pressure: 0.044mmHg at 25°C
• Refractive Index: 1.431
• CAS DataBase Reference: diisobutyl malonate(CAS DataBase Reference)
• NIST Chemistry Reference: diisobutyl malonate(50780-99-9)
• EPA Substance Registry System: diisobutyl malonate(50780-99-9)

Safety Data

• Hazardous Substances Data: 50780-99-9(Hazardous Substances Data)

Usage

InChI:InChI=1/C11H20O4/c1-8(2)6-14-10(12)5-11(13)15-7-9(3)4/h8-9H,5-7H2,1-4H3

Upstream product

• 78-83-1 2-methyl-propan-1-ol 
• 141-82-2 malonic acid 
• 3375-31-3 palladium diacetate 
• 543-27-1 isobutyl chloroformate 

Downstream Products

• 1195989-20-8 C₂₀H₂₈O₄ 
• 1195989-21-9 C₂₁H₃₀O₄ 
• 1195989-11-7 (E)-1-methyl-3-phenyl-allyl-malonic acid di-iso-butyl ester 
• 1195989-22-0 di-iso-butyl 2-((Z)-4-benzyloxy-but-2-enyl)malonate 
• 1195989-14-0 di-iso-butyl 2-((E)-4-benzyloxy-but-2-enyl)malonate 
• 1379609-83-2 2-(methoxy(phenyl)methyl)-2-(2-methylbut-3-en-2yl)malononitrile 
• 1379610-25-9 2-(methoxy(phenyl)methyl)-2-(3-methylbut-2-en-1-yl)malononitrile 
• 116279-93-7 C₂₆H₃₀O₄ 
• 541-41-3 chloroformic acid ethyl ester 
• 125563-02-2 diethyl isobutyl methanetricarboxylate 
• 125563-03-3 ethyl-diisobutyl methanetricarboxylate 

Relevant articles and documents

Ligand-dependent mechanistic dichotomy in iron-catalyzed allylic substitutions: σ-allyl versus π-allyl mechanism

(Chemical Equation Presented) Iron at the crossroads: A remarkable mechanistic dichotomy in iron-catalyzed allylic substition increases not only the scope of regioselective allylic alkylation but could also herald the development of asymmetric allylic substitution (see Scheme, MTBE = methyl tert-butyl ether). Depending on the ligand used, either a σ-or a π-allyl mechanism is observed.