1-Chloro-2-cyclopropylbenzene

Base Information

• Chemical Name: 1-Chloro-2-cyclopropylbenzene
• CAS No.: 10292-67-8
• Molecular Formula: C9H9Cl
• Molecular Weight: 152.62100
• Hs Code.: 2902900000
• DSSTox Substance ID: DTXSID10481361
• Wikidata: Q82316721
• Mol file: 10292-67-8.mol

Synonyms:1-CHLORO-2-CYCLOPROPYLBENZENE;10292-67-8;Benzene, 1-chloro-2-cyclopropyl-;1-Chloro-2-cyclopropyl-Benzene;SCHEMBL1897406;DTXSID10481361;FT-0738488;A18029

Chemical Property of 1-Chloro-2-cyclopropylbenzene

Chemical Property:

• PSA: 0.00000
• LogP: 3.21740
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 152.0392780
• Heavy Atom Count: 10
• Complexity: 118

Purity/Quality:

97% ^*data from raw suppliers

1-Chloro-2-cyclopropylbenzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC1C2=CC=CC=C2Cl

Technology Process of 1-Chloro-2-cyclopropylbenzene

There total 8 articles about 1-Chloro-2-cyclopropylbenzene 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: 66.0%

2-chlorophenyl triflate (66107-36-6) + cyclopropylzinc chloride (203861-73-8) → 1-chloro-2-cyclopropylbenzene (10292-67-8)

Guidance literature:

With di-μ-iodobis(tri-t-butylphosphino)dipalladium(l); In 1-methyl-pyrrolidin-2-one; at 20 ℃; for 0.166667h; chemoselective reaction;

DOI:10.1002/anie.201808386

Reference yield: 44.0%

cyclopropylbenzene (873-49-4) → 3-cyclopropylchlorobenzene (19714-74-0) + 1-chloro-2-cyclopropylbenzene (10292-67-8) + (+/-)-(1,3-dichloropropyl)benzene (14155-36-3) + 1-phenylchlorocyclopropane (116005-40-4)

Guidance literature:

With clorine; Further byproducts given; hypochlorite-based phase-transfer method;

DOI:10.1016/S0040-4039(00)99390-0

Reference yield: 26.0%

cyclopropylbenzene (873-49-4) → 1-chloro-4-cyclopropylbenzene (1798-84-1) + 3-cyclopropylchlorobenzene (19714-74-0) + 1-chloro-2-cyclopropylbenzene (10292-67-8) + (+/-)-(1,3-dichloropropyl)benzene (14155-36-3) + 1-phenylchlorocyclopropane (116005-40-4)

Guidance literature:

With clorine; Product distribution; different initial pH values were used pH:8.6;

DOI:10.1016/S0040-4039(00)99390-0

upstream raw materials:

bis((1-methylcyclopropyl)formyl)peroxide

chlorobenzene

cyclopropylbenzene

2-monochlorophenol

Downstream raw materials:

5-(2-chlorophenyl)-1,2-oxathiolane 2-oxide

5-(2-chlorophenyl)-1,2-oxathiolane 2-oxide

5-(2-chlorophenyl)-4,5-dihydroisoxazole

2-Chlor-6-nitrosopropiophenon

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