(1R,2R)-2-(3-chlorophenyl)cyclopropane-1-carboxylic Acid

Base Information

• Chemical Name: (1R,2R)-2-(3-chlorophenyl)cyclopropane-1-carboxylic Acid
• CAS No.: 16633-45-7
• Molecular Formula: C₁₀H₉ClO₂
• Molecular Weight: 196.633
• European Community (EC) Number: 816-725-8
• Mol file: 16633-45-7.mol

Synonyms:16633-45-7;(1R,2R)-2-(3-chlorophenyl)cyclopropane-1-carboxylic Acid;rac-(1R,2R)-2-(3-chlorophenyl)cyclopropane-1-carboxylic acid, trans;Rel-(1R,2R)-2-(3-chlorophenyl)cyclopropane-1-carboxylic acid;trans-2-(3-Chlorophenyl)cyclopropanecarboxylic Acid;SCHEMBL7000518;AC8358;EN300-250781;Z2250620212;rac-(1R,2R)-2-(3-chlorophenyl)cyclopropane-1-carboxylic acid

Chemical Property of (1R,2R)-2-(3-chlorophenyl)cyclopropane-1-carboxylic Acid

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 196.0291072
• Heavy Atom Count: 13
• Complexity: 217

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1C(C1C(=O)O)C2=CC(=CC=C2)Cl
• Isomeric SMILES: C1[C@H]([C@@H]1C(=O)O)C2=CC(=CC=C2)Cl

Technology Process of (1R,2R)-2-(3-chlorophenyl)cyclopropane-1-carboxylic Acid

There total 10 articles about (1R,2R)-2-(3-chlorophenyl)cyclopropane-1-carboxylic Acid 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: 94.0%

(1RS,2RS)-ethyl 2-(3-chlorophenyl)cyclopropanecarboxylate → trans-2-(3-chlorophenyl)-cyclopropanecarboxylic acid (16633-45-7,91552-11-3)

Guidance literature:

With water; sodium hydroxide; In tetrahydrofuran; at 65 ℃; for 5h;

Reference yield: 80.0%

→ trans-2-(3-chlorophenyl)-cyclopropanecarboxylic acid (16633-45-7,91552-11-3)

Guidance literature:

Reference yield:

diazoacetic acid ethyl ester (623-73-4) + 3-Chlorostyrene (2039-85-2,26100-04-9) → trans-2-(3-chlorophenyl)-cyclopropanecarboxylic acid (16633-45-7,91552-11-3)

Guidance literature:

With xylene; at 140 - 150 ℃; Erwaermen des Reaktionsprodukts mit aethanol. Natriumaethylat und Hydrolysieren des Esters durch Zusatz von H₂O;

DOI:10.1021/ja01548a051

upstream raw materials:

diazoacetic acid ethyl ester

3-Chlorostyrene

trans-2-(m-nitrophenyl)cyclopropanecarboxylic acid

m-Chlorocinnamic acid

Downstream raw materials:

(+)-(1S,2S)-2-(3-chlorophenyl)cyclopropanecarboxylic acid

(3R,4R)-tert-butyl 3-((6-(bis(tert-butoxycarbonyl)amino)-4-methylpyridin-2-yl)methyl)-4-(2-((1S,2R/1R,2S)-2-(3-chlorophenyl)cyclopropylamino)ethoxy)pyrrolidine-1-carboxylate

trans-2-(3-chlorophenyl)cyclopropan-1-amine hydrochloride