623-82-5

Basic information

• Product Name: (+)-3-METHYLHEXANEDIOIC ACID
• Synonyms: (R)-(+)-3-METHYLADIPIC ACID;METHYLHEXANEDIOIC ACID;Hexanedioic acid, 3-methyl-, (R)-;(3R)-3-Methylhexanedioic acid;(+)-3-Methyladipic acid,96%;(3R)-(+)-3-Methyladipic acid;(3R)-(+)-3-Methylhexane-1,6-dioic acid, (2R)-(+)-2-Methylbutane-1,4-dicarboxylic acid
• CAS NO: 623-82-5
• Molecular Formula: C₇H₁₂O₄
• Molecular Weight: 160.17
• EINECS: 210-816-0
• Product Categories: Building Blocks;C7;Carbonyl Compounds;Carboxylic Acids;Chemical Synthesis;Organic Building Blocks
• Mol File: 623-82-5.mol
• Article Data: 14

Chemical Properties

• Melting Point: 81-84 °C(lit.)
• Boiling Point: 230 °C30 mm Hg(lit.)
• Flash Point: 170.6 °C
• Appearance: white to light yellow powder
• Density: 1.3681 (rough estimate)
• Vapor Pressure: 1.47E-05mmHg at 25°C
• Refractive Index: 1.4336 (estimate)
• Storage Temp.: 2-8°C
• BRN: 4661826
• CAS DataBase Reference: (+)-3-METHYLHEXANEDIOIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: (+)-3-METHYLHEXANEDIOIC ACID(623-82-5)
• EPA Substance Registry System: (+)-3-METHYLHEXANEDIOIC ACID(623-82-5)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36
• WGK Germany: 3
• Hazardous Substances Data: 623-82-5(Hazardous Substances Data)

Usage

Chemical Properties

white to light yellow powder

InChI:InChI=1/C7H12O4/c1-5(4-7(10)11)2-3-6(8)9/h5H,2-4H2,1H3,(H,8,9)(H,10,11)/p-2/t5-/m1/s1

Upstream product

• 99356-87-3 (R)-5-cyano-4-methyl-valeric acid 
• 101084-14-4 3-methyl-1,6-adiponitrile 
• 51097-61-1 3-methylhexan-1,6-dial 
• 5208-51-5 (-)(1S:5S)-cis-1-Methyl-5-isopropenyl-cyclohex-3-en 
• 89-82-7 (+)-pulegone 
• 110659-28-4 (R)-(+)-5-acetoxy-4-methylpentanoic acid 
• 589-92-4 1-methylcyclohexan-4-one 
• 56493-06-2 6-hydroxy-4-methylhexanoic acid 
• 186581-53-3 diazomethane 
• 151-50-8 potassium cyanide 
• 18951-85-4 (R)-citronellic acid 
• 89-82-7 pulegone 
• 31558-25-5 2,6-dimethyl-2,3,8-octanetriol 
• 60-29-7 diethyl ether 

Downstream Products

• 6672-30-6 (R)-3-methylcyclopentanone 
• 1757-42-2 3-methyl-cyclopentanone 
• 1321624-40-1 (6R)-N-(4-methoxyphenyl)-N,2,6-trimethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-aminium chloride 
• 1583281-12-2 C₁₅H₁₈O₃ 
• 1583281-98-4 C₁₉H₂₄O₅ 
• 1402081-42-8 (R)-3-methyl-N¹,N⁶-diphenylhexanediamide 
• 82136-11-6 (R)-(+)-3-methylcyclopentanone 2,4-dinitrophenylhydrazone 

Relevant articles and documents

Enantioselective baeyer-villiger oxidation: Desymmetrization of meso cyclic ketones and kinetic resolution of racemic 2-arylcyclohexanones

Catalytic enantioselective Baeyer-Villiger (BV) oxidations of racemic and meso cyclic ketones were achieved in the presence of chiral N,N'-dioxide-Sc III complex catalysts. The BV oxidations of prochiral cyclohexanones and cyclobutanones afforded series of optically active μ- and γ-lactones, respectively, in up to 99% yield and 95% ee. Meanwhile, the kinetic resolution of racemic 2-arylcyclohexanones was also realized via an abnormal BV oxidation. Enantioenriched 3-aryloxepan-2-ones, whose formation is counter to the migratory aptitude, were obtained preferentially. Both the lactones and the unreacted ketones were obtained with high ee values.

Enantioselective baeyer-villiger oxidation: Desymmetrization of meso cyclic ketones and kinetic resolution of racemic 2-arylcyclohexanones

Catalytic enantioselective Baeyer-Villiger (BV) oxidations of racemic and meso cyclic ketones were achieved in the presence of chiral N,N'-dioxide-Sc III complex catalysts. The BV oxidations of prochiral cyclohexanones and cyclobutanones afforded series of optically active μ- and γ-lactones, respectively, in up to 99% yield and 95% ee. Meanwhile, the kinetic resolution of racemic 2-arylcyclohexanones was also realized via an abnormal BV oxidation. Enantioenriched 3-aryloxepan-2-ones, whose formation is counter to the migratory aptitude, were obtained preferentially. Both the lactones and the unreacted ketones were obtained with high ee values.