Triflumuron
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Basic information
- CAS
64628-44-0- Standard SMILES
O=C(NC(=O)c1ccccc1Cl)Nc1ccc(OC(F)(F)F)cc1- InChIKey
XAIPTRIXGHTTNT-UHFFFAOYSA-N- Molecular formula
- C15H10ClF3N2O3
- Average molar mass
- 358.7 g/mol
- Monoisotopic mass
- 358.0332044
Overview
Triflumuron is an aromatic ether, an organofluorine compound, a benzoylurea insecticide and a member of monochlorobenzenes.
Names & identifiers
- Preferred name
- Triflumuron
- IUPAC
- 2-chloro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide
- English name
- Triflumuron
- Molecular formula
- C15H10ClF3N2O3
- Molecular weight
- 358.7
Names & synonyms
Triflumuron64628-44-0TrifluronSIR 8514DTXSID50343552-Chloro-N-(((4-(trifluoromethoxy)phenyl)amino)carbonyl)benzamide3FT64DYG8K2-chloro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benzamideBAY SIR 85141-(o-chlorobenzoyl)-3-(p-(trifluoromethoxy)phenyl)urea2-chloro-N-((4-(trifluoromethoxy)phenyl)carbamoyl)benzamideDTXCID3014355
Show more names
MascotOMS 2015BAYSIRAlystinsir8514BAY-8514BAYCIDALALSYSTINSTARYCIDE
CHEBI:393882-chloro-N-{[4-(trifluoromethoxy)phenyl]carbamoyl}benzamide2-chloro-N-({[4-(trifluoromethoxy)phenyl]amino}carbonyl)benzamideBAY-Sir-8514RefChem:1915681-(4-trifluoromethoxyphenyl)-3-(2-chlorobenzoyl)urea2-chloro-N-(4-(trifluoromethoxy)phenylaminocarbonyl)benzamide2-chloro-N-((((4-trifluoromethoxy)phenyl)amino)carbonyl)benzamide
Database identifiers
- CAS
64628-44-0- PubChem CID
- 47445
- DTXSID
DTXSID5034355- ChEMBL
CHEMBL1394379- ChEBI
CHEBI:39388- UNII
- 3FT64DYG8K
- EC Number
- 264-980-3
- Nikkaji
- J20.690C
Properties
Computed structural propertiesFilling in
- XLogP
- 5.6
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 454
Experimental & physicochemical properties
Pesticides
Insecticides
Active substance -> EU Pesticides database: Not approved
LogP4.91
Collision Cross Section
179.1 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID5034355]
169.88 Ų [M+H]+ [CCS Type: TW]
Physicochemical properties
- Melting point
- 198 ℃ · 198℃
- Density
- 1.475 · 1.475±0.06 g/cm3(Predicted)
- vapor pressure
- 0 Pa · 0Pa at 20℃
- storage temp.
- 0 · 0-6°C
- solubility
- Soluble in DMF
- pka
- 9.79 · 9.79±0.46(Predicted)
- form
- Solid
- color
- White to off-white
- Water Solubility
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H330 (56.5%): Fatal if inhaled [Danger Acute toxicity, inhalation]
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.
Hazard information
Regulatory Information
Commission Regulation (EC) No 33/2008
2011/23/EU, Reg. (EU) 2022/801, Reg. (EU) No 540/2011
REACH registered substance: 2-chloro-N-[[[4-(trifluoromethoxy)phenyl]amino]carbonyl]benzamide (EC: 264-980-3)
Triflumuron: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Benzamide, 2-chloro-N-[[[4-(trifluoromethoxy)phenyl]amino]carbonyl]-: Environment tier I assessment
Hazard Classes and CategoriesAcute Tox. 2 (56.5%)
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type N95 (US)
- wgk
- 2
- rtecs
- CV2474000
- Toxicity
- LD50 in rats, mice (mg/kg): >5000, >5000 i.p., s.c., orally (Zoebelein)
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- safety_code
- 22-24/25
- Storage Class
Chemistry & industry
Pharmacology
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.
Applications
DescriptionTriflumuron, 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.
UsesA chitin biosynthesis inhibitor
UsesTriflumuron is a benzoylphenylurea insecticide. Triflumuron is a chitin synthesis inhibitor used to control insects pests such as mosquitos and flies.
UsesInsecticide (larvicide).
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: Triflumuron is a benzoylurea insecticide, a member of monochlorobenzenes, an organofluorine compound and an aromatic ether.
Related reactions
2 records
Compound notes
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