YQ9Cyr6zjm

Base Information

Chemical Name:YQ9Cyr6zjm
CAS No.:260561-48-6
Molecular Formula:C₁₇H₁₉NO₅
Molecular Weight:317.342
Hs Code.:
UNII:YQ9CYR6ZJM
Nikkaji Number:J2.561.253A

Synonyms:KW 4490;KW-4490;KW4490;4-cyano-4-(2,3-dihydro-8-methoxy-1,4-benzodioxin-5-yl)cyclohexanecarboxylic acid;KF 66490;KF-66490;KF66490

Suppliers and Price of YQ9Cyr6zjm

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of YQ9Cyr6zjm

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:317.12632271
Heavy Atom Count:23
Complexity:491

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=C2C(=C(C=C1)C3(CCC(CC3)C(=O)O)C#N)OCCO2

Technology Process of YQ9Cyr6zjm

There total 14 articles about YQ9Cyr6zjm 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: 98.0%

: 444108-44-5
ethyl 4-cyano-4-(2,3-dihydro-8-methoxy-1,4-benzodioxin-5-yl)-3-cyclohexanecarboxylate

: 260561-48-6
cis-4-cyano-4-(2,3-dihydro-8-methoxy-1,4-benzodioxin-5-yl)cyclohexanecarboxylic acid

Guidance literature:: With potassium hydroxide; In ethanol; at 20 ℃; for 1.5h;
DOI:10.1021/ol902244e

Reference yield: 67.0%

: 7758-19-2
sodium chlorite

: sodium dihydrogen phosphate

: 513-35-9
2-methyl-but-2-ene

: 260561-51-1
cis-4-Cyano-4-(8-methoxy-1,4-benzodioxan-5-yl)cyclohexane carbaldehyde

: 260561-48-6
cis-4-cyano-4-(2,3-dihydro-8-methoxy-1,4-benzodioxin-5-yl)cyclohexanecarboxylic acid

Guidance literature:: With sodium hydroxide; sodium hydrogen sulphite; In tert-butyl alcohol;

Reference yield:

: 444108-43-4
4-(2,3-dihydro-8-methoxy-1,4-benzodioxin-5-yl)-3-cyclohexenecarboxylic acid

: 7677-24-9
trimethylsilyl cyanide

: 260561-48-6
cis-4-cyano-4-(2,3-dihydro-8-methoxy-1,4-benzodioxin-5-yl)cyclohexanecarboxylic acid

: 468730-62-3
4-cyano-4-(2,3-dihydro-8-methoxy-1,4-benzodioxin-5-yl)cyclohexanecarboxylic acid

Guidance literature:: trimethylsilyl cyanide; With trifluorormethanesulfonic acid; In 4-methyl-1,2,3-trifluorobenzene; at -20 ℃; for 0.0833333h; Inert atmosphere;

4-(2,3-dihydro-8-methoxy-1,4-benzodioxin-5-yl)-3-cyclohexenecarboxylic acid; In 4-methyl-1,2,3-trifluorobenzene; at -20 - 0 ℃; optical yield given as %de; Inert atmosphere;
DOI:10.1021/ol902244e