(1R-cis)-2,2-Dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl chloride

Base Information

• Chemical Name: (1R-cis)-2,2-Dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl chloride
• CAS No.: 53955-46-7
• Molecular Formula: C10H15ClO
• Molecular Weight: 186.681
• European Community (EC) Number: 258-886-1
• DSSTox Substance ID: DTXSID801135189
• Nikkaji Number: J279.546I

Synonyms:53955-46-7;(1R-cis)-2,2-Dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl chloride;SCHEMBL8409028;VNTCVNLNEOVBEE-YUMQZZPRSA-N;DTXSID801135189;(1R,3S) 2,2-dimethyl-3-(2-methyl-1-propenyl)-cyclopropane-1-carboxylic acid chloride;Cyclopropanecarbonyl chloride, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (1R-cis)-

Chemical Property of (1R-cis)-2,2-Dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl chloride

Chemical Property:

• PSA: 17.07000
• LogP: 2.99020
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 186.0811428
• Heavy Atom Count: 12
• Complexity: 236

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CC1C(C1(C)C)C(=O)Cl)C
• Isomeric SMILES: CC(=C[C@H]1[C@H](C1(C)C)C(=O)Cl)C

Technology Process of (1R-cis)-2,2-Dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl chloride

There total 10 articles about (1R-cis)-2,2-Dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl chloride 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: 81.0%

chrysanthemumic acid (10453-89-1) → 3-(2-methyl-1-propenyl)-2,2-dimethylcyclopropanecarbonyl chloride (4489-12-7,4489-14-9,26770-95-6,28684-92-6,34909-52-9,51348-74-4,53955-46-7,56650-12-5,14297-81-5)

Guidance literature:

With oxalyl dichloride; In dichloromethane; at 20 ℃; for 6h;

Reference yield: 70.0%

cis-Chrysanthemic acid (2935-23-1) → cis-Chrysanthemic acid chloride (4489-12-7,4489-14-9,14297-81-5,26770-95-6,28684-92-6,34909-52-9,51348-74-4,53955-46-7,56650-12-5)

Guidance literature:

With thionyl chloride; for 1h; Heating;

DOI:10.1055/s-1982-29786

Reference yield:

→ 3-(2-methyl-1-propenyl)-2,2-dimethylcyclopropanecarbonyl chloride (4489-12-7,4489-14-9,26770-95-6,28684-92-6,34909-52-9,51348-74-4,53955-46-7,56650-12-5,14297-81-5)

Guidance literature:

Aus entspr. (-)-trans-Saeurechlorid u. BCl3;

upstream raw materials:

chrysanthemumic acid

ethyl 2,2-dimethyl-3-(2-methylpropenyl)cyclopropanecarboxylate

cis-Chrysanthemic acid

1-bromo-2,2-dimethylcyclopropane

Downstream raw materials:

chrysanthemumic acid-[2,2,2-trichloro-1-(4-chloro-phenyl)-ethyl ester]

Chrysanthemumsaeure-isobutylester

Chrysanthemumsaeure-

Chrysanthemumsaeure-allylester

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