200636-22-2

Basic information

• Product Name: Propanoic acid, 2,2-diMethyl-,3-[(1S,2R)-2-hydroxy-3-(phenylMethoxy)-1-[(phenylMethoxy)Methyl]propoxy]propyl ester
• Synonyms: Propanoic acid, 2,2-diMethyl-,3-[(1S,2R)-2-hydroxy-3-(phenylMethoxy)-1-[(phenylMethoxy)Methyl]propoxy]propyl ester;2,2-Dimethylpropanoic acid 3-[(1S,2R)-2-hydroxy-3-(phenylmethoxy)-1-[(phenylmethoxy)methyl]propoxy]propyl ester
• CAS NO: 200636-22-2
• Molecular Formula: C₂₆H₃₆O₆
• Molecular Weight: 444.56044
• EINECS: -0
• Mol File: 200636-22-2.mol
• Article Data: 4

Chemical Properties

• Boiling Point: 555.2±50.0 °C(Predicted)
• Appearance: /
• Density: 1.106±0.06 g/cm3(Predicted)
• PKA: 13.42±0.20(Predicted)
• CAS DataBase Reference: Propanoic acid, 2,2-diMethyl-,3-[(1S,2R)-2-hydroxy-3-(phenylMethoxy)-1-[(phenylMethoxy)Methyl]propoxy]propyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: Propanoic acid, 2,2-diMethyl-,3-[(1S,2R)-2-hydroxy-3-(phenylMethoxy)-1-[(phenylMethoxy)Methyl]propoxy]propyl ester(200636-22-2)
• EPA Substance Registry System: Propanoic acid, 2,2-diMethyl-,3-[(1S,2R)-2-hydroxy-3-(phenylMethoxy)-1-[(phenylMethoxy)Methyl]propoxy]propyl ester(200636-22-2)

Safety Data

• Hazardous Substances Data: 200636-22-2(Hazardous Substances Data)

Usage

General Description

Propanoic acid, 2,2-dimethyl-, 3-[(1S,2R)-2-hydroxy-3-(phenylmethoxy)-1-[(phenylmethoxymethyl]propoxy]propyl ester is a chemical compound that belongs to the group of carboxylic acid esters. It is commonly used as an intermediate in the synthesis of pharmaceuticals and other organic compounds. This chemical may also have potential applications in the field of medicine and drug development due to its unique properties. Its molecular formula is C21H28O6, and it has a molecular weight of 376.446 grams per mole. The chemical structure consists of a propanoic acid core, with additional functional groups attached to it, making it suitable for various chemical reactions and applications.

Upstream product

• 3282-30-2 pivaloyl chloride 
• 200636-15-3 (2R,3S)-1,4-dibenzyloxy-3-(3-hydroxypropoxy)butan-2-ol 
• 68973-05-7 (2R*,3S*)-2,3-bis((benzyloxy)methyl)oxirane 
• 80183-15-9 (2R,3R)-1,4-bis(benzyloxy)-2,3-epoxy butane 

Downstream Products

• 1006908-55-9 (2S,3R)-3-[(4-nitrobenzoyl)oxy-1,4-bisbenzyloxybutan-2-yloxy]propyl pivalate 
• 915160-20-2 (2S,3S)-3-(1,4-bisbenzyloxy-3-hydroxybutan-2-yloxy)propyl pivalate 
• 239100-36-8 (5Z,7E)-(1R,2R,3R,24S)-1,3,24-tris(tert-butyldimethylsilyloxy)-2-(3-tertbutyldimethylsilyloxypropoxy)-9,10-secocholesta-5,7,10⁽¹⁹⁾-triene 
• 239100-37-9 (5Z,7E)-(1R,2R,3R,24R)-1,3,24-tris(tert-butyldimethylsilyloxy)-2-(3-tertbutyldimethylsilyloxypropoxy)-9,10-secocholesta-5,7,10⁽¹⁹⁾-triene 

Relevant articles and documents

Synthesis of 20-epi-eldecalcitol [20-epi-1α,25-dihydroxy-2β-(3-hydroxypropoxy)vitamin D3: 20-epi-ED-71]

A convergent synthesis of biologically interesting 20-epi-eldecalcitol which possesses an inverted C-21 methyl substituent at the 20-position of the side chain of 1α,25-dihydroxy-2β-(3-hydroxypropoxy)vitamin D3 (eldecalcitol) is described.

Synthesis and biological characterization of 1α,24,25-trihydroxy-2β-(3-hydroxypropoxy)vitamin D3 (24-hydroxylated ED-71)

24-Hydroxylated derivatives were synthesized in 24(R) and 24(S) forms by the convergent method as analogs related to 1α,25-dihydroxy-2β-(3-hydroxypropoxy)vitamin D3. In the convergent synthesis, the A-ring fragment, synthesized from diethyl D-tartarate, and the C/D-ring fragments in 24(R) and 24(S) forms (vitamin D numbering), obtained from vitamin D2 via the Inhoffen-Lythgoe diol, were coupled in moderate yields to give 1α,24(R),25-trihydroxy-2β-(3-hydroxypropoxy)vitamin D3 and 1α,24(S),25-trihydroxy-2β-(3-hydroxypropoxy)vitamin D3. In preliminary biological evaluations, 24-hydroxylation of 1α,25-dihydroxy-2β-(3-hydroxypropoxy)vitamin D3 caused weakened affinity to vitamin D binding protein in vitro and less calcemic activity in vivo compared to the parent compound. While the affinity to vitamin D receptor in 24(R) epimer was sustained, the affinity in 24(S) epimer was less than that of the parent compound. Copyright