40226-04-8

Basic information

• Product Name: ethyl 2-(diethoxyphosphoryl)octanoate
• Synonyms: Octanoic acid, 2- (diethoxyphosphinyl)-, ethyl ester
• CAS NO: 40226-04-8
• Molecular Formula: C₁₄H₂₉O₅P
• Molecular Weight: 308.3508
• Mol File: 40226-04-8.mol
• Article Data: 9

Chemical Properties

• Boiling Point: 377.6°C at 760 mmHg
• Flash Point: 195.8°C
• Density: 1.026g/cm³
• Vapor Pressure: 6.66E-06mmHg at 25°C
• Refractive Index: 1.439
• CAS DataBase Reference: ethyl 2-(diethoxyphosphoryl)octanoate(CAS DataBase Reference)
• NIST Chemistry Reference: ethyl 2-(diethoxyphosphoryl)octanoate(40226-04-8)
• EPA Substance Registry System: ethyl 2-(diethoxyphosphoryl)octanoate(40226-04-8)

Safety Data

• Hazardous Substances Data: 40226-04-8(Hazardous Substances Data)

Upstream product

• 867-13-0 diethoxyphosphoryl-acetic acid ethyl ester 
• 111-25-1 1-bromo-hexane 
• 124-07-2 Octanoic acid 
• 638-45-9 1-Iodohexane 
• 138286-76-7 ethyl-2-bromooctanoate 
• 122-52-1 triethyl phosphite 

Downstream Products

• 177587-43-8 1-(4-methoxy-3-phenethyloxy-benzyl)-heptylamine 
• 177587-26-7 N-t-butoxycarbonyl-1-hexyl-2-[4-methoxy-3-(2-phenylethoxy)-phenyl]ethylamine 
• 1414882-83-9 (2E,4Z)-tert-butyl 6-benzylamino-5-hexyl-6-oxohexa-2,4-dienoate 
• 1414882-74-8 N-methoxyl-N-methyl-N’-benzyl-5-hexyl-hexa-2E,4Z-diendiamide 
• 1414882-57-7 (2E,4Z)-n-butyl 6-benzylamino-5-hexyl-6-oxohexa-2,4-dienoate 
• 35045-86-4 α-aminoheptanephosphonic acid 

Relevant articles and documents

Stereo- and chemoselective cross-coupling between two electron-deficient acrylates: An efficient route to (Z, E)-muconate derivatives

A Ru-catalyzed direct oxidative cross-coupling reaction of acrylates was developed. It offers a straightforward and atom-economical protocol for the synthesis of functionalized (Z,E)-muconate derivatives in moderate to good yields with good stereo- and chemoselectivities. The conjugated muconates bearing differentiable terminal functionality can be selectively transformed into versatile synthetic intermediates widely used in organic synthesis.

Synthesis and characterization of novel phosphonocarboxylate inhibitors of RGGT

Phosphonocarboxylate (PC) analogs of the anti-osteoporotic drugs, bisphosphonates, represent the first class of selective inhibitors of Rab geranylgeranyl transferase (RabGGTase, RGGT), an enzyme implicated in several diseases including ovarian, breast and skin cancer. Here we present the synthesis and biological characterization of an extended set of this class of compounds, including lipophilic derivatives of the known RGGT inhibitors. From this new panel of PCs, we have identified an inhibitor of RGGT that is of similar potency as the most active published phosphonocarboxylate, but of higher selectivity towards prenyl pyrophosphate synthases. New insights into structural requirements are also presented, showing that only PC analogs of the most potent 3rd generation bisphosphonates inhibit RGGT. In addition, the first phosphonocarboxylate-derived GGPPS weak inhibitor is reported.

Ruthenium- and rhodium-catalyzed cross-coupling reaction of acrylamides with alkenes: Efficient access to (Z,E)-dienamides

Ruthenium- and rhodium-catalyzed direct oxidative cross-coupling reactions of acrylamides with alkenes were developed. These methods provide an efficient route for the synthesis of (Z,E)-dienamides in excellent yields with good stereoselectivity. The catalytic systems allowed oxidative olefination of a wide range of alkenes bearing different functional groups, such as CO2R, COMe, SO2Ph, aryl, CONHBn, CN, PO(OEt)2, as well as Weinreb amide.