Grundinformationen
- Standard-SMILES
O=C(NC(=O)c1ccccc1Cl)Nc1ccc(OC(F)(F)F)cc1- InChIKey
XAIPTRIXGHTTNT-UHFFFAOYSA-N- Summenformel
- C15H10ClF3N2O3
- Durchschnittliche Molmasse
- 358,7 g/mol
- Monoisotopische Masse
- 358,0332044
Namen und Bezeichner
- Bevorzugter Name
- Triflumuron
- IUPAC
- 2-chloro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide
- Lokaler Name
- 2-Chlor-N-[[[4-(trifluormethoxy)phenyl]amino]carbonyl]benzamid
- Englischer Name
- Triflumuron
- Summenformel
- C15H10ClF3N2O3
- Molmasse
- 358.7
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
64628-44-0- PubChem CID
- 47445
- DTXSID
DTXSID5034355- ChEMBL
CHEMBL1394379- ChEBI
CHEBI:39388- UNII
- 3FT64DYG8K
- EC Number
- 264-980-3
- Nikkaji
- J20.690C
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,6
- Polarare Oberfläche (TPSA)
- 67,4 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 24
- Formalladung
- 0
- Komplexität
- 454
Experimentelle und physikochemische Eigenschaften
Collision Cross Section
179.1 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID5034355];186.6 Ų [M+Na]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID5034355]
169.88 Ų [M+H]+ [CCS Type: TW]
Physikochemische Eigenschaften
- Schmelzpunkt
- 198 ℃ · 198℃
- Dichte
- 1.475 · 1.475±0.06 g/cm3(Predicted)
- Dampfdruck
- 0 Pa · 0Pa at 20℃
- storage temp.
- 0 · 0-6°C
- Löslichkeit
- Soluble in DMF
- pka
- 9.79 · 9.79±0.46(Predicted)
- Aggregatzustand
- Solid
- Farbe
- White to off-white
- Wasserlöslichkeit
- 40 μg/L · 40μg/L at 20℃
- BRN
- 2776684 · 2776684
- Henry's Law Constant
- 1.1 · 1.1×103 mol/(m3Pa) at 25℃, Ebert et al. (2023)
- Major Application
- agricultureenvironmental
- InChI
- 1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)
- InChIKey
- XAIPTRIXGHTTNT-UHFFFAOYSA-N
- SMILES
- FC(F)(F)Oc1ccc(NC(=O)NC(=O)c2ccccc2Cl)cc1
- LogP
- 4.68 at · 4.68 at 25℃
- CAS Datenbank
- 64628 · 64628-44-0(CAS DataBase Reference)
- EPA chemische Informationen
- Triflumuron (64628-44-0)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H330 (56.5%): Fatal if inhaled [Danger Acute toxicity, inhalation];H400 (43.5%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410 (43.5%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
P260, P271, P273, P284, P304+P340, P316, P320, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 69 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Regulatory Information
Commission Regulation (EC) No 33/2008
2011/23/EU, Reg. (EU) 2022/801, Reg. (EU) No 540/2011
Status: Active Update: 09-11-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/33074
Triflumuron: Does not have an individual approval but may be used under an appropriate group standard
Regulatorische Informationen
Regulatory Information
Commission Regulation (EC) No 33/2008
2011/23/EU, Reg. (EU) 2022/801, Reg. (EU) No 540/2011
Status: Active Update: 09-11-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/33074
Triflumuron: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- wgk
- 2
- RTECS-Nr.
- CV2474000
- Toxizität
- LD50 in rats, mice (mg/kg): >5000, >5000 i.p., s.c., orally (Zoebelein)
- safety_code
- 22-24/25
- Speicherklasse
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- Hazard Classifications
- Acute Tox. 2 Inhalation
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological Classification
Compounds that cause reproductive sterility in organisms. They are sometimes used to control pest populations by sterilizing males within the population.
Pesticides designed to control insects that are harmful to man. The insects may be directly harmful, as those acting as disease vectors, or indirectly harmful, as destroyers of crops, food products, or textile fabrics.
Anwendungen
BeschreibungTriflumuron, a benzoylphenyl urea compound, is an insect development inhibitor that inhibits the synthesis of chitin. It is formulated as an off-shears pour-on lousicide for control of the sheep body louse Bovicola ovis.
VerwendenTriflumuron is a benzoylphenylurea insecticide. Triflumuron is a chitin synthesis inhibitor used to control insects pests such as mosquitos and flies.
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