(4R)-2,2-diethyl-1,3-dioxolane-4-carbaldehyde

Base Information

• Chemical Name: (4R)-2,2-diethyl-1,3-dioxolane-4-carbaldehyde
• CAS No.: 120157-60-0
• Molecular Formula: C8H14 O3
• Molecular Weight: 158.197
• DSSTox Substance ID: DTXSID70472755
• Nikkaji Number: J467.841I
• Wikidata: Q82301878
• Mol file: 120157-60-0.mol

Synonyms:120157-60-0;2,3-o-(3-Pentylidene)-D-glyceraldehyde;(4R)-2,2-diethyl-1,3-dioxolane-4-carbaldehyde;SCHEMBL7479352;DTXSID70472755;AKOS006240217;AC-11861;1,3-Dioxolane-4-carboxaldehyde,2,2-diethyl-,(4R)-;(R)-2,2-DIETHYL-1,3-DIOXOLANE-4-CARBALDEHYDE

Chemical Property of (4R)-2,2-diethyl-1,3-dioxolane-4-carbaldehyde

Chemical Property:

• Vapor Pressure: 0.204mmHg at 25°C
• Boiling Point: 209.4°Cat760mmHg
• Flash Point: 70.6°C
• PSA: 35.53000
• Density: 1.047g/cm³
• LogP: 1.11700
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 158.094294304
• Heavy Atom Count: 11
• Complexity: 140

Purity/Quality:

98%min ^*data from raw suppliers

2,3-O-(3-PENTYLIDENE)-D-GLYCERALDEHYDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1(OCC(O1)C=O)CC
• Isomeric SMILES: CCC1(OC[C@@H](O1)C=O)CC

Technology Process of (4R)-2,2-diethyl-1,3-dioxolane-4-carbaldehyde

There total 3 articles about (4R)-2,2-diethyl-1,3-dioxolane-4-carbaldehyde which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 76.0%

1,2:5,6-di-O-(3-pentylidene)-D-mannitol (120157-59-7) → (R)-2,2-diethyl-1,3-dioxolane-4-carboxaldehyde (120157-60-0)

Guidance literature:

With potassium metaperiodate; potassium hydrogencarbonate; In tetrahydrofuran; water; at 23 - 25 ℃; for 3h;

DOI:10.1055/s-1992-26170

Reference yield:

2,3-O-(3-pentylidene)-D-glyceraldehyde hydrate → (R)-2,2-diethyl-1,3-dioxolane-4-carboxaldehyde (120157-60-0)

Guidance literature:

at 43 - 44 ℃; under 0.3 Torr;

DOI:10.1055/s-1992-26170

Reference yield:

(1R,2S)-1,2-Bis-((R)-2,2-diethyl-[1,3]dioxolan-4-yl)-ethane-1,2-diol → (R)-2,2-diethyl-1,3-dioxolane-4-carboxaldehyde (120157-60-0)

Guidance literature:

With potassium metaperiodate;

DOI:10.1016/S0040-4039(99)00438-4

upstream raw materials:

1,2:5,6-di-O-(3-pentylidene)-D-mannitol

Downstream raw materials:

(3R,4R,5R,6S)-5-Bromo-6-((R)-2,2-diethyl-[1,3]dioxolan-4-yl)-3-methoxy-4-methyl-tetrahydro-pyran-2-one

(3R,4S,5S)-5-{[(1S)-3,3-diethyl-2,4-dioxolanyl]bromomethyl}-3-methoxy-4-methyloxolan-2-one

(S)-1-((R)-2,2-diethyl-1,3-dioxolan-4-yl)prop-2-ynyl 4-methylbenzenesulfonate

tert-Butyl-[(S)-3-((R)-2,2-diethyl-[1,3]dioxolan-4-yl)-3-methoxy-2,2-dimethyl-propoxy]-diphenyl-silane