DIPROPYLPROPYLAL

Base Information

• Chemical Name: DIPROPYLPROPYLAL
• CAS No.: 4744-11-0
• Molecular Formula: C9H20O2
• Molecular Weight: 160.257
• European Community (EC) Number: 878-348-5
• DSSTox Substance ID: DTXSID10334585
• Nikkaji Number: J112.974K
• Wikidata: Q82100452
• Mol file: 4744-11-0.mol

Synonyms:1,1-dipropoxy-propane;Propane,1,1-dipropoxy;propanal dipropyl acetal;1,1-Dipropoxy-propan;Propane, 1,1-dipropoxy-;propionaldehyde dipropyl acetal;Propionaldehyddipropylacetal;

Chemical Property of DIPROPYLPROPYLAL

Chemical Property:

• Vapor Pressure: 1.83mmHg at 25°C
• Boiling Point: 171.8oC at 760 mmHg
• Flash Point: 37.3oC
• PSA: 18.46000
• Density: 0.842g/cm3
• LogP: 2.57570
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 160.146329876
• Heavy Atom Count: 11
• Complexity: 66

Purity/Quality:

99% ^*data from raw suppliers

PropanalDipropylAcetal ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCOC(CC)OCCC

Technology Process of DIPROPYLPROPYLAL

There total 12 articles about DIPROPYLPROPYLAL 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: 96.0%

propan-1-ol (71-23-8) + N-allyl-N-phenylpivalamide (762243-62-9) → 1,1-dipropoxypropane (4744-11-0) + N-pivaloylaniline (6625-74-7)

Guidance literature:

rhodium(III) chloride; for 5h; Heating;

DOI:10.1021/jo070553t

Reference yield: 96.0%

propan-1-ol (71-23-8) + N-allyl-N-[(1S)-1-phenylethyl]-3-phenylpropanamide → 1,1-dipropoxypropane (4744-11-0) + N-(3-phenylpropanoyl)-(S)-1-phenylethylamine (200803-30-1)

Guidance literature:

rhodium(III) chloride; for 6h; Heating;

DOI:10.1021/jo070553t

Reference yield: 94.0%

propan-1-ol (71-23-8) + Benzo[1,3]dioxole-5-carboxylic acid allyl-methyl-amide (114908-29-1) → 1,1-dipropoxypropane (4744-11-0) + N-methylbenzo[d][1,3]dioxole-5-carboxamide (15777-84-1)

Guidance literature:

rhodium(III) chloride; for 6h; Heating;

DOI:10.1021/jo070553t

upstream raw materials:

propan-1-ol

N-allyl-N-phenylpivalamide

4-bromo-N-allyl-N-methyl-benzamide

Benzo[1,3]dioxole-5-carboxylic acid allyl-methyl-amide

Downstream raw materials:

cis-propenyl propyl ether

(E)-1-Propoxy-propene

2-ethyl-1,3-dioxolane

propan-1-ol

Refernces

• 1、 Zacuto, Michael J.,Xu, Feng. "One-step RhCl3-catalyzed deprotection of acyclic N-allyl amides". . p. 6298 - 6300. Retrieved 2008/02/10.