6065-59-4

Basic information

• Product Name: DIETHYL PENTYLMALONATE
• Synonyms: 2-pentyl-malonicaciddiethylester;2-pentyl-propanedioicaciddiethylester;DIETHYL N-AMYLMALONATE;DIETHYL PENTYLMALONATE;DIETHYL AMYLMALONATE;N-AMYLMALONIC ACID, DIETHYL ESTER;Hexane-1,1-dicarboxylic acid diethyl ester;Pentylmalonic acid diethyl ester
• CAS NO: 6065-59-4
• Molecular Formula: C₁₂H₂₂O₄
• Molecular Weight: 230.3
• EINECS: 227-997-7
• Mol File: 6065-59-4.mol
• Article Data: 17

Chemical Properties

• Boiling Point: 254-255 °C
• Flash Point: 121 °C
• Appearance: /
• Density: 0.9630
• Vapor Pressure: 0.0104mmHg at 25°C
• Refractive Index: n20/D 1.426
• PKA: 13.23±0.46(Predicted)
• CAS DataBase Reference: DIETHYL PENTYLMALONATE(CAS DataBase Reference)
• NIST Chemistry Reference: DIETHYL PENTYLMALONATE(6065-59-4)
• EPA Substance Registry System: DIETHYL PENTYLMALONATE(6065-59-4)

Safety Data

• Hazard Codes: Xi
• Safety Statements: 23-24/25
• WGK Germany: 3
• HazardClass: IRRITANT
• Hazardous Substances Data: 6065-59-4(Hazardous Substances Data)

Usage

General Description

Diethyl Pentylmalonate is a synthetic chemical compound that is primarily used in the fragrance and flavouring industry. This organic compound has a fruity smell and is often used in perfumes or to give a specific scent to products. It falls under the ester class of organic compounds, sharing characteristics of both alcohols and carboxylic acids. It's also known as Heptanoic acid and Diethyl malonate. As an industrial chemical, it must be handled with care given its potential irritant effect on skin and eyes.

InChI:InChI=1/C12H22O4/c1-4-7-8-9-10(11(13)15-5-2)12(14)16-6-3/h10H,4-9H2,1-3H3

Upstream product

• 5256-74-6 1,3-diethyl 2-diazopropanedioate 
• 109-66-0 pentane 
• 64-17-5 ethanol 
• 766550-98-5 diethyl 2-(pent-4-en-1-ylidene)malonate 
• 18255-47-5 heptanoyl bromide 
• 110-53-2 1-Bromopentane 
• 105-53-3 diethyl malonate 
• 543-59-9 1-Chloropentane 
• 628-17-1 amyl iodide 
• 71007-44-8 pentyl-oxalacetic acid diethyl ester 
• 117123-40-7 pentyl-malonyl bromide 

Downstream Products

• 105838-94-6 5-pentyl-2-propyl-1H-pyrimidine-4,6-dione 
• 18755-33-4 Amyl-(2-cyan-aethyl)-malonsaeure-diaethylester 
• 44902-02-5 (2S)-2-aminoheptanoic acid 
• 44902-01-4 (R)-2-aminoheptanoic acid 
• 1115-90-8 2-aminoheptanoic acid 
• 56384-28-2 N-Hydroxy-2-pentyl-N'-phenyl-malonamide 
• 56384-33-9 2-Phenylcarbamoyl-heptanoic acid ethyl ester 
• 94762-98-8 6-Tridecylphenyl-carbinol 
• 95706-46-0 6-benzyl-tridecane 
• 103980-53-6 6-amino-2-methyl-5-pentyl-3H-pyrimidin-4-one 
• 86468-73-7 4,4'-bis-(<2,2-(2)H2>heptyloxy)azoxybenzene 
• 77517-83-0 bis(2,4,6-trichlorophenyl) n-pentylmalonate 
• 120268-61-3 C₃₆H₃₆N₂O₉ 
• 14077-67-9 2,4,6-trichloro-5-pentyl-pyrimidine 

Relevant articles and documents

CYCLOALKYL-CONTAINING CARBOXYLIC ACIDS AND USES THEREOF

The present application discloses a compound of formula (I) or a salt thereof: (I) and compositions comprising such compound or salt thereof. The use of such compound, salt thereof or composition comprising same for treating anemia or leukopenia, fibrosis, cancer, hypertension and/or a metabolic condition in a subject is also disclosed.

Peptide deformylase inhibitors of Mycobacterium tuberculosis: Synthesis, structural investigations, and biological results

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New racemic 1,4-disubstituted piperazines chemically named ethyl 2-[(4-pyrimidin-2yl-piperazine-1yl)carbonyl]C3-C5-alkanoates 1-7 were synthesized. The compounds were resolved into enantiomers on cellulose tris(4-methylbenzoate) and amylose tris(3,5-dimethylphenylcarbamate) stationary phases using hexane/propan-2-ol mobile phases. The optimum separation conditions for the compounds were obtained on cellulose tris(4-methylbenzoate) with 5% of 2-propanol in hexane. The relationship between structural and chromatographic parameters is discussed.