2-CHLORO-1,1-DIMETHOXYPROPANE

Base Information

• Chemical Name: 2-CHLORO-1,1-DIMETHOXYPROPANE
• CAS No.: 87894-32-4
• Molecular Formula: C5H11ClO2
• Molecular Weight: 138.594
• Hs Code.: 2911000000
• European Community (EC) Number: 629-569-9
• DSSTox Substance ID: DTXSID40408920
• Mol file: 87894-32-4.mol

Synonyms:2-Chloropropionaldehyde dimethyl acetal;2-chloro-1,1-dimethoxy-propane;2-chloro-1,1-bis(methyloxy)propane;Cl-PADMA;Propane,2-chloro-1,1-dimethoxy;2-chloropropanal dimethyl acetal;

Chemical Property of 2-CHLORO-1,1-DIMETHOXYPROPANE

Chemical Property:

• Vapor Pressure: 11.8mmHg at 25°C
• Boiling Point: 126-127oC(lit.)
• Flash Point: 35oC
• PSA: 18.46000
• Density: 1.059 g/mL at 20oC(lit.)
• LogP: 1.23260
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 138.0447573
• Heavy Atom Count: 8
• Complexity: 54.4

Purity/Quality:

98%min ^*data from raw suppliers

2-CHLOROPROPIONALDEHYDE DIMETHYL ACETAL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 10-22-43
• Safety Statements: 36/37

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C(OC)OC)Cl

Technology Process of 2-CHLORO-1,1-DIMETHOXYPROPANE

There total 2 articles about 2-CHLORO-1,1-DIMETHOXYPROPANE 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: 13.0%

dimethoxypropane (4744-10-9) → methyl hexanoate (106-70-7) + 2-chloropropionaldehyde dimethyl acetal (87894-32-4)

Guidance literature:

With manganese(IV) oxide; chloro-trimethyl-silane; manganese(ll) chloride; In methanol; acetonitrile; at 40 ℃; for 6h;

DOI:10.1016/S0040-4020(01)81231-X

Reference yield: 13.0%

methanol (67-56-1) + propionaldehyde (123-38-6) → methyl hexanoate (106-70-7) + 2-chloropropionaldehyde dimethyl acetal (87894-32-4)

Guidance literature:

With manganese(IV) oxide; chloro-trimethyl-silane; manganese(ll) chloride; In acetonitrile; at 40 ℃; for 6h;

DOI:10.1016/S0040-4020(01)81231-X

Reference yield: 94.0%

4-Amino-2,6-dihydroxypyrimidine (873-83-6) + 2-chloropropionaldehyde dimethyl acetal (87894-32-4) → 5-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diol (67856-03-5)

Guidance literature:

2-chloropropionaldehyde dimethyl acetal; With hydrogenchloride; sodium acetate; In water; at 95 ℃; for 0.233333h;

4-Amino-2,6-dihydroxypyrimidine; With sodium acetate; In water; Heating / reflux;

upstream raw materials:

dimethoxypropane

methanol

propionaldehyde

Downstream raw materials:

2-chloro-propionic acid methyl ester

methyl 2,2-dichloropropionate

3-ethyl-3H-7-methyl-imidazo[2,1-i]purine

5-methyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diol

Refernces