Saflufenacil

Base Information

Chemical Name:Saflufenacil
CAS No.:372137-35-4
Molecular Formula:C17H17ClF4N4O5S
Molecular Weight:500.858
Hs Code.:
European Community (EC) Number:619-504-2
UNII:189U20M808
ChEMBL ID:CHEMBL2251845
DSSTox Substance ID:DTXSID9058072
Nikkaji Number:J2.666.561B
Wikidata:Q7398820
Wikipedia:Saflufenacil
Mol file:372137-35-4.mol

Synonyms:N'-(2-chloro-4-fluoro-5-(3-methyl-2,6-dioxo-4(trifluoromethyl)-3,6-dihydro-1(2H)-pyrimidinyl)benzoyl)-N-isopropyl-N-methylsulfamide;saflufenacil

Suppliers and Price of Saflufenacil

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

TRC
Saflufenacil
100mg
$ 1265.00

Sigma-Aldrich
Saflufenacil PESTANAL
100mg
$ 296.00

American Custom Chemicals Corporation
SAFLUFENACIL 95.00%
5MG
$ 496.39

Total 0 raw suppliers

Chemical Property of Saflufenacil

Chemical Property:

PKA:4.24±0.40(Predicted)
PSA：118.86000
Density:1.542g/cm³
LogP:3.13400
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:5
Exact Mass:500.0544312
Heavy Atom Count:32
Complexity:921

Purity/Quality:: Saflufenacil ^*data from reagent suppliers

Safty Information:

Pictogram(s): 11326826
Hazard Codes:N
Statements: 50/53
Safety Statements: 61

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)N(C)S(=O)(=O)NC(=O)C1=CC(=C(C=C1Cl)F)N2C(=O)C=C(N(C2=O)C)C(F)(F)F

Technology Process of Saflufenacil

There total 6 articles about Saflufenacil 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: 92.5%

: 854122-75-1
2-chloro-5-[3,6-dihydro-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl]-4-fluoro-N-{[methyl(1-methylethyl)amino]sulfonyl}-benzamide

: 77-78-1
dimethyl sulfate

: 372137-35-4
saflufenacil

: C₁₈H₁₉ClF₄N₄O₅S

Guidance literature:: With potassium hydroxide; tetrabutylammomium bromide; In tetrahydrofuran; water; toluene; at 25 - 40 ℃; for 4h; pH=5.3 - 5.5; Product distribution / selectivity;

Reference yield: 88.9%

: 854122-75-1
2-chloro-5-[3,6-dihydro-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl]-4-fluoro-N-{[methyl(1-methylethyl)amino]sulfonyl}-benzamide

: 77-78-1
dimethyl sulfate

: 372137-35-4
saflufenacil

Guidance literature:: With sodium hydroxide; tetrabutylammomium bromide; In tetrahydrofuran; water; toluene; at 25 ℃; for 23h; Product distribution / selectivity;

Reference yield: 47.0%

: 372136-76-0
2-[methyl(sulfamoyl)amino]propane

: 120890-57-5
2-chloro-5-(3,6-dihydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl)-4-fluoro-benzoic acid

: 372137-35-4
saflufenacil

Guidance literature:: 2-chloro-5-(3,6-dihydro-3-methyl-2,6-dioxo-4-(trifluoromethyl)-1(2H)-pyrimidinyl)-4-fluoro-benzoic acid; With 1,1'-carbonyldiimidazole; In tetrahydrofuran; for 1h; Reflux; Inert atmosphere;

2-[methyl(sulfamoyl)amino]propane; With 1,8-diazabicyclo[5.4.0]undec-7-ene; In tetrahydrofuran; at 20 ℃; for 24h; Inert atmosphere;