(E)-19-iodononadec-18-enoic acid

Base Information

Chemical Name:(E)-19-iodononadec-18-enoic acid
CAS No.:95978-55-5
Molecular Formula:C₁₉H₃₅IO₂
Molecular Weight:422.39
Hs Code.:2916190090
ChEMBL ID:CHEMBL168666
Mol file:95978-55-5.mol

Synonyms:19-iodo-18-nonadecenoic acid;19-iodo-18-nonadecenoic acid, (E)-isomer, 123I-labeled;19-iodo-18-nonadecenoic acid, (E)-isomer, 125I-labeled;19-IVN

Suppliers and Price of (E)-19-iodononadec-18-enoic acid

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 3 raw suppliers

Chemical Property of (E)-19-iodononadec-18-enoic acid

Chemical Property:

Vapor Pressure:3.49E-10mmHg at 25°C
Boiling Point:471.3°Cat760mmHg
Flash Point:238.8°C
PSA：37.30000
Density:1.209g/cm³
LogP:7.26130
XLogP3:8.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:17
Exact Mass:422.16818
Heavy Atom Count:22
Complexity:264

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C(CCCCCCCCC(=O)O)CCCCCCCC=CI
Isomeric SMILES:C(CCCCCCCCC(=O)O)CCCCCCC/C=C/I

Technology Process of (E)-19-iodononadec-18-enoic acid

There total 4 articles about (E)-19-iodononadec-18-enoic 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: 67.0%

: 95978-54-4
methyl (E)-19-iodo-18-nonadecenoate

: 95978-55-5
(E)-19-iodo-18-nonadecenoic acid

Guidance literature:: With sodium hydroxide; In ethanol; for 1h; Heating;
DOI:10.1021/jm00383a020

Reference yield:

: 60451-92-5
17-Iodheptadecansaeure

: 95978-55-5
(E)-19-iodo-18-nonadecenoic acid

Guidance literature:: Multi-step reaction with 4 steps

1: 85 percent / hexamethylphosphoric acid triamide / 0.5 h / 0 °C

2: 92 percent / diethyl ether / 12 h / 0 - 5 °C

3: 1.) (n-Bu)3SnH, azobisbutyronitrile, 2.) iodine monochloride / 1.) toluene, reflux, 6 h, 2.) CCl₄

4: 67 percent / 1 N aq. NaOH / ethanol / 1 h / Heating

With sodium hydroxide; 2,2-azobisbutyronitrile; tri-n-butyl-tin hydride; Iodine monochloride; In N,N,N,N,N,N-hexamethylphosphoric triamide; diethyl ether; ethanol;
DOI:10.1021/jm00383a020

Reference yield:

: 95978-51-1
18-nonadecynoic acid

: 95978-55-5
(E)-19-iodo-18-nonadecenoic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 92 percent / diethyl ether / 12 h / 0 - 5 °C

2: 1.) (n-Bu)3SnH, azobisbutyronitrile, 2.) iodine monochloride / 1.) toluene, reflux, 6 h, 2.) CCl₄

3: 67 percent / 1 N aq. NaOH / ethanol / 1 h / Heating

With sodium hydroxide; 2,2-azobisbutyronitrile; tri-n-butyl-tin hydride; Iodine monochloride; In diethyl ether; ethanol;
DOI:10.1021/jm00383a020