CAS 129558-76-5 Tolfenpyrad (HCID 10110536)

Überblick

Tolfenpyrad is an aromatic amide obtained by formal condensation of the carboxy group of 4-chloro-3-ethyl-1-methylpyrazole-5-carboxylic acid with the amino group of 1-[4-(4-methylphenoxy)phenyl]methylamine. It has a role as an agrochemical, an antifungal agent, a mitochondrial NADH:ubiquinone reductase inhibitor and an EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor. It is a pyrazole insecticide, an aromatic ether, an organochlorine compound and an aromatic amide.

Namen und Bezeichner

Bevorzugter Name: Tolfenpyrad
IUPAC: 4-chloro-3-ethyl-1-methyl-N-[[4-(4-methylphenoxy)phenyl]methyl]pyrazole-5-carboxamide
Englischer Name: TOLFENPYRAD
Summenformel: C21H22ClN3O2
Molmasse: 383.87

Namen und Synonyme

tolfenpyrad129558-76-5OHA74571QT4-chloro-3-ethyl-1-methyl-N-(4-(p-tolyloxy)benzyl)pyrazole-5-carboxamideDTXSID6057952CHEBI:386284-chloro-3-ethyl-1-methyl-N-((4-(4-methylphenoxy)phenyl)methyl)-1H-pyrazole-5-carboxamide4-CHLORO-3-ETHYL-1-METHYL-N-[4-(P-TOLYLOXY)BENZYL]PYRAZOLE-5-CARBOXAMIDE4-chloro-3-ethyl-1-methyl-N-[4-(4-methylphenoxy)benzyl]-1H-pyrazole-5-carboxamide4-Chloro-3-ethyl-1-methyl-N-{[4-(4-methylphenoxy)phenyl]methyl}-1H-pyrazole-5-carboxamide4-chloro-3-ethyl-1-methyl-N-(4-(4-methylphenoxy)benzyl)-1H-pyrazole-5-carboxamideRefChem:190289

Weitere Namen anzeigen

omi-88HATI-HATIolfenpyra2-ethanediolTolfenapyradTOLFENPYRAD STANDARDC17591500 Tolfenpyradtolfenpyrad (bsi, pa iso)

DTXCID4031720603-342-4Tolfenpyrad [ISO]MFCD082738504-chloro-5-ethyl-2-methyl-N-[[4-(4-methylphenoxy)phenyl]methyl]pyrazole-3-carboxamideMMV6889344-chloro-3-ethyl-1-methyl-N-(4-(p-tolyloxy)benzyl)-1H-pyrazole-5-carboxamide4-Chloro-3-ethyl-1-methyl-N-(4-(p-tolyloxy)-benzyl)-1H-pyrazole-5-carboxamide

Datenbank-Bezeichner

CAS: 129558-76-5
PubChem CID: 10110536
DTXSID: DTXSID6057952
ChEMBL: CHEMBL2229099
ChEBI: CHEBI:38628
UNII: OHA74571QT
EC Number: 603-342-4
Nikkaji: J1.215.839D

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 4,7
Polarare Oberfläche (TPSA): 56,2 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 6
Schwere Atome: 27
Formalladung: 0
Komplexität: 476

Experimentelle und physikochemische Eigenschaften

Pesticides · 3 Einträge

Agrochemicals -> Pesticide active substances

Active substance -> EU Pesticides database: Not approved

Pesticide (Tolfenpyrad) -> USDA PDB

Physikochemische Eigenschaften

Schmelzpunkt: 87 · 87~89℃
Siedepunkt: 540 · 540.0±50.0 °C(Predicted)
Dichte: 1.21 · 1.21±0.1 g/cm3(Predicted)
storage temp.: 0 · 0-6°C
Löslichkeit: Chloroform (Slightly), DMSO (Slightly)
pka: 13.11 · 13.11±0.46(Predicted)
Aggregatzustand: Solid
Farbe: White to off-white
BRN: 13666608 · 13666608
InChI: InChI=1S/C21H22ClN3O2/c1-4-18-19(22)20(25(3)24-18)21(26)23-13-15-7-11-17(12-8-15)27-16-9-5-14(2)6-10-16/h5-12H,4,13H2,1-3H3,(H,23,26)
InChIKey: WPALTCMYPARVNV-UHFFFAOYSA-N
SMILES: N1(C)C(C(NCC2=CC=C(OC3=CC=C(C)C=C3)C=C2)=O)=C(Cl)C(CC)=N1
CAS Datenbank: 129558 · 129558-76-5
EPA chemische Informationen: 1 H-Pyrazole-5-carboxamide, · 1H-Pyrazole-5-carboxamide, 4-chloro-3-ethyl-1-methyl-N-[[4-(4-ethylphenoxy)phenyl]methyl]- (129558-76-5)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

Danger

H302+H332 (78.8%): Harmful if swallowed or if inhaled [Warning Acute toxicity, oral; acute toxicity, inhalation]

P260, P261, P264, P270, P271, P273, P301+P317, P304+P340, P317, P319, P330, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 85 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H301: Toxic if swallowed [Danger Acute toxicity, oral]

Gefahrenhinweise

Regulatory InformationTolfenpyrad is listed in the dataset of EPA Human Health Benchmarks for Pesticides under the Safe Drinking Water Act (40 eCFR 141)

Hazard Classes and Categories · 3 Einträge

Acute Tox. 4 (97.6%)

Acute toxicity (Oral) - Category 3

Toxikologische Informationen

RAIS Toxicity Values · 4 Einträge

0.1

OPP

0.006

OPP

EPA Human Health Benchmarks for Pesticides · 6 Einträge

Tolfenpyrad

0.1

700

Children

0.006

40

Sicherheitsdaten

wgk: 3
ridadr: UN 3077 9 / PGIII
risk_code: 20/22-50/53
hazard_code: Xn,N
safety_code: 60-61
Speicherklasse: 11 - Combustible Solids
Hazard Classifications: Acute Tox. 4 InhalationAcute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1

Chemie und Industrie

Anwendungen

VerwendenTolfenpyrad

Anbieter100 Anbieter

湖北博杰生物科技有限公司0713-2060728 15629612610

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]

Ergänzende Hinweise

DefinitionChEBI: An aromatic amide obtained by formal condensation of the carboxy group of 4-chloro-3-ethyl-1-methylpyrazole-5-carboxylic acid with the amino group of 1-[4-(4-methylphenoxy)phenyl]methylamine.