Diafenthiuron
Grundinformationen
- CAS
80060-09-9- Standard-SMILES
CC(C)c1cc(Oc2ccccc2)cc(C(C)C)c1NC(=S)NC(C)(C)C- InChIKey
WOWBFOBYOAGEEA-UHFFFAOYSA-N- Summenformel
- C23H32N2OS
- Durchschnittliche Molmasse
- 384,6 g/mol
- Monoisotopische Masse
- 384,22353482
Namen und Bezeichner
- Bevorzugter Name
- Diafenthiuron
- IUPAC
- 1-tert-butyl-3-[4-phenoxy-2,6-di(propan-2-yl)phenyl]thiourea
- Englischer Name
- Diafenthiuron
- Summenformel
- C23H32N2OS
- Molmasse
- 384.58
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
80060-09-9- PubChem CID
- 3034380
- DTXSID
DTXSID1041845- ChEBI
CHEBI:39299- UNII
- 22W5MDB01G
- EC Number
- 616-885-7
- Nikkaji
- J409.511A
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 6
- Polarare Oberfläche (TPSA)
- 65,4 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 6
- Schwere Atome
- 27
- Formalladung
- 0
- Komplexität
- 447
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- 144.6 · 144.6-147.7°C
- Siedepunkt
- 448.8 · 448.8±55.0 °C(Predicted)
- Dichte
- 1.0367 · 1.0367 (rough estimate)
- Brechungsindex
- 1.595 · 1.5950 (estimate)
- Flammpunkt
- 149 °C · 149 °C
- storage temp.
- 0 · 0-6°C
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
- pka
- 12 · 12+-.0.70(Predicted)
- Farbe
- White to Off-White
- Wasserlöslichkeit
- 0.1 mg/mL · Water: < 0.1 mg/mL (insoluble)
- Merck
- 13 · 13,2988
- BRN
- 8343025 · 8343025
- Major Application
- agricultureenvironmental
- InChI
- 1S/C23H32N2OS/c1-15(2)19-13-18(26-17-11-9-8-10-12-17)14-20(16(3)4)21(19)24-22(27)25-23(5,6)7/h8-16H,1-7H3,(H2,24,25,27)
- InChIKey
- WOWBFOBYOAGEEA-UHFFFAOYSA-N
- SMILES
- CC(C)c1cc(Oc2ccccc2)cc(C(C)C)c1NC(=S)NC(C)(C)C
- CAS Datenbank
- 80060 · 80060-09-9(CAS DataBase Reference)
- EPA chemische Informationen
- Diafenthiuron (80060-09-9)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H331 (54.1%): Toxic if inhaled [Danger Acute toxicity, inhalation];H332 (45.9%): Harmful if inhaled [Warning Acute toxicity, inhalation];H373 (55.3%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure];H400 (55.3%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410 (55.3%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
P260, P261, P271, P273, P304+P340, P316, P317, P319, P321, P391, P403+P233, P405, 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.;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
Hazard Classes and Categories
Acute Tox. 3 (54.1%);Acute Tox. 4 (45.9%);STOT RE 2 (55.3%);Aquatic Acute 1 (55.3%);Aquatic Chronic 1 (55.3%)
Acute toxicity (Oral) - Category 4;Acute toxicity (Inhalation: Dusts and mists) - Category 2;Serious eye damage/eye irritation - Category 2A;Specific target organ toxicity - Single exposure - Category 1 (respiratory system);Specific target organ toxicity - Repeated exposure - Category 2 (kidney);Hazardous to the aquatic environment (Acute) - Category 1;Hazardous to the aquatic environment (Long-term) - Category 1
Regulatorische Informationen
Sicherheitsdaten
- wgk
- 2
- ridadr
- UN 2811
- hs_code
- 29309090
- RTECS-Nr.
- XN9100000
- risk_code
- 20
- Toxizität
- LD50 in rats (mg/kg): 2068 orally; >2000 dermally; LC50 (14 hr) in rats: 558 mg/m3 by inhalation (Streibert, 1988)
- hazard_code
- Xn
- safety_code
- 22
- hazard_class
- 6.1(a)
- packing_group
- II
- Speicherklasse
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- Acute Tox. 3 InhalationAquatic Acute 1Aquatic Chronic 1STOT RE 2
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
BeschreibungDiafenthiuron is a broad spectrum acaricide and insecticide, diafenthiuron is registered for use on cotton, soybeans, vegetables, fruit and ornamentals. It controls all post-hatch stages of mites, whiteflies and aphids. Its ability to control all sucking pests of cotton as well as mites, with no known toxicity to beneficial insects, is unique and very valuable in cotton integrated pest management (IPM) programs.
VerwendenDiafenthiuron is an insecticide.
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