1-Bromo-2-chloropropane

Base Information

• Chemical Name: 1-Bromo-2-chloropropane
• CAS No.: 3017-96-7
• Molecular Formula: C3H6BrCl
• Molecular Weight: 157.438
• Hs Code.: 2903799090
• European Community (EC) Number: 221-158-9
• DSSTox Substance ID: DTXSID90871004
• Nikkaji Number: J205.319E
• Mol file: 3017-96-7.mol

Synonyms:1-BROMO-2-CHLOROPROPANE;3017-96-7;Propane, 1-bromo-2-chloro-;EINECS 221-158-9;1-bromo-2 chloropropane;1-bromo-2-chloro-propane;SCHEMBL809430;DTXSID90871004;AKOS006274759;Propane,1-bromo-2-chloro-(6ci,7ci,8ci,9ci)

Chemical Property of 1-Bromo-2-chloropropane

Chemical Property:

• Vapor Pressure: 22.696mmHg at 25°C
• Refractive Index: 1.465
• Boiling Point: 115.345 °C at 760 mmHg
• Flash Point: 27.55 °C
• PSA: 0.00000
• Density: 1.529 g/cm³
• LogP: 2.00860
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 155.93414
• Heavy Atom Count: 5
• Complexity: 22.9

Purity/Quality:

98%min ^*data from raw suppliers

1-BROMO-2-CHLOROPROPANE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CBr)Cl
• Use Description: 1-Bromo-2-chloropropane, a halogenated organic compound, has several applications across different fields. In the field of organic synthesis, it serves as a valuable reagent for introducing halogen atoms into various organic molecules, facilitating the creation of new compounds with specific properties. In the pharmaceutical industry, it can be used as an intermediate in the synthesis of pharmaceuticals and agrochemicals. In the chemical manufacturing sector, it finds utility as a starting material for the production of specialty chemicals and solvents. Additionally, 1-bromo-2-chloropropane can also be employed as a fumigant in agriculture, aiding in pest control. Its versatile nature and reactivity make it valuable in these diverse applications, contributing to advancements in chemistry, pharmaceuticals, chemical manufacturing, and agriculture.

Technology Process of 1-Bromo-2-chloropropane

There total 17 articles about 1-Bromo-2-chloropropane 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: 16.0%

3-chloroprop-1-ene (107-05-1) → 1,2-Dibromopropane (78-75-1) + 1-bromo-2-chloropropane (3017-96-7) + 2-bromo-1-chloropropane (3017-95-6,127054-44-8,130232-86-9) + allyl bromide (106-95-6)

Guidance literature:

With hydrogen bromide; ferric(III) bromide; In dichloromethane; at 25 ℃; for 0.5h;

DOI:10.1039/c39870001013

Reference yield: 5.0%

3-chloroprop-1-ene (107-05-1) → 1,2-Dibromopropane (78-75-1) + 1-bromo-2-chloropropane (3017-96-7)

Guidance literature:

With hydrogen bromide; ferric(III) bromide; In dichloromethane; at 25 ℃; for 15h;

DOI:10.1039/c39870001013

Reference yield:

sulfuryl dichloride (7791-25-5) + dilauryl peroxide (105-74-8) + propyl bromide (106-94-5) → 1-bromo-2-chloropropane (3017-96-7) + 1.3-chlorobromopropane (109-70-6)

Guidance literature:

DOI:10.1021/ja01877a048

upstream raw materials:

1-bromo-1-propene

1,2-Dibromopropane

2-chloropropene

propene

Downstream raw materials:

hydrogen bromide

Refernces

• 1、 Bredikhin, A. A.,Kirillovich, V. A.,Safin, I. A.,Vereshchagin, A. N.. "COMPETITION BETWEEN n,?- AND n,?-ORBITAL INTERACTIONS IN CHLORINATED ETHERS R-O-CHClR1". . p. 2185 - 2189. Retrieved 2007/10/02.