Sumi-alpha

Base Information

Chemical Name:Sumi-alpha
CAS No.:67614-33-9
Deprecated CAS:73367-17-6
Molecular Formula:C₂₅H₂₂ClNO₃
Molecular Weight:419.908
Hs Code.:
European Community (EC) Number:878-110-0
DSSTox Substance ID:DTXSID3020621

Synonyms:(R,R)-Fenvalerate;67614-33-9;DTXSID3020621;Sumi-alpha;DTXCID201475882;67890-40-8;Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, cyano(3-phenoxyphenyl)methyl ester, (R*,R*)-;CAS-67614-33-9;S 5602B-beta;SCHEMBL1765690;pydrin, (S-(R*,R*))-isomer;Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, cyano(3-phenoxyphenyl)methyl ester, (R-(R*,R*))-;Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, cyano(3-phenoxyphenyl)methyl ester, (S-(R*,R*))-;Tox21_201838;Tox21_302957;NCGC00256483-01;NCGC00259387-01;LS-28684;Z3356129830;Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, cyano (3-phenoxyphenyl)methyl ester, (S-(R*,R*))-;Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, cyano (3-phenoxyphenyl)methyl ester,(S-(R*,R*))-;Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-,cyano(3-phenoxyphenyl)methyl ester, (R*,R*)-;Benzeneacetic acid,?4-chloro-.alpha.-(1-methylethyl)-, (R)-cyano(3-phenoxyphenyl)methyl ester, (.alpha.R)-

Suppliers and Price of Sumi-alpha

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 6 raw suppliers

Chemical Property of Sumi-alpha

Chemical Property:

Density:1.21
XLogP3:6.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:419.1288213
Heavy Atom Count:30
Complexity:586

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3
Isomeric SMILES:CC(C)[C@H](C1=CC=C(C=C1)Cl)C(=O)O[C@@H](C#N)C2=CC(=CC=C2)OC3=CC=CC=C3

Technology Process of Sumi-alpha

There total 5 articles about Sumi-alpha 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:

: 63640-09-5
(R)-2-(4-chlorophenyl)-3-methylbutyric acid

: 67614-33-9,67890-40-8
(R)-α-cyano-3-phenoxybenzyl (R)-2-(4-chlorophenyl)isovalerate

Guidance literature:: Multi-step reaction with 2 steps

1: SOCl₂; DMF / CHCl₃ / 1 h / 60 °C

2: 441 mg / pyridine / CH₂Cl₂ / 0.5 h

With pyridine; thionyl chloride; N,N-dimethyl-formamide; In dichloromethane; chloroform; 1: Chlorination / 2: Acylation;
DOI:10.1021/jf981210m

Reference yield:

: 39515-51-0
3-Phenoxybenzaldehyde

: 67614-33-9,67890-40-8
(R)-α-cyano-3-phenoxybenzyl (R)-2-(4-chlorophenyl)isovalerate

Guidance literature:: Multi-step reaction with 2 steps

1: HCl / tetrahydrofuran; H₂O / 0.5 h / 20 °C

2: 441 mg / pyridine / CH₂Cl₂ / 0.5 h

With pyridine; hydrogenchloride; In tetrahydrofuran; dichloromethane; water; 1: Addition / 2: Acylation;
DOI:10.1021/jf981210m