Grundinformationen
- Standard-SMILES
COC(C)(C)CCC[C@H](C)C/C=C/C(C)=C/C(=O)OC(C)C- InChIKey
NFGXHKASABOEEW-GYMWBFJFSA-N- Summenformel
- C19H34O3
- Durchschnittliche Molmasse
- 310,5 g/mol
- Monoisotopische Masse
- 310,25079494
Namen und Bezeichner
- Bevorzugter Name
- S-Methoprene
- IUPAC
- propan-2-yl (2E,4E,7S)-11-methoxy-3,7,11-trimethyldodeca-2,4-dienoate
- Englischer Name
- S-(+)-Methoprene
- Summenformel
- C19H34O3
- Molmasse
- 310.47
Namen und Synonyme
S-Methoprene65733-16-6(S)-methoprene(7S)-MethopreneExtinguishPrecod-MethopreneDiacon II(+)-Methopreneisopropyl (2E,4E,7S)-11-methoxy-3,7,11-trimethyldodeca-2,4-dienoateFlea Killer Plus7S)-Methoprene
Weitere Namen anzeigen
S-Methoprene @100 μg/mL in Methanol(2E,4E,7S-)-11-Methoxy-3,7,11-trimethyl-2,4-dodecadienoic acid isopropyl ester(7S)-Form7S-MethopreneS-ImidaclopridS-MethoxypreneS-(+)-Methoprene
Altoside CP 2Altoside CP 10Altosid XR BriquetsMethoprene, (S)-propan-2-yl (2E,4E,7S)-11-methoxy-3,7,11-trimethyldodeca-2,4-dienoatePharoridDTXSID10357834YIQ0A94UR
Datenbank-Bezeichner
- CAS
40596-69-8、65733-16-6- PubChem CID
- 1711973
- DTXSID
DTXSID1035783- ChEBI
CHEBI:39255- UNII
- 4YIQ0A94UR
- EC Number
- 613-834-0
- Nikkaji
- J344.494E
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,5
- Polarare Oberfläche (TPSA)
- 35,5 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 11
- Schwere Atome
- 22
- Formalladung
- 0
- Komplexität
- 378
Experimentelle und physikochemische Eigenschaften
Collision Cross Section187 Ų [M+Na]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
Physikochemische Eigenschaften
- Siedepunkt
- 385.7 · 385.7±25.0 °C(Predicted)
- Dichte
- 0.913 · 0.913±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- Löslichkeit
- 20 mg/ml,Ethanol: · DMF: 20 mg/ml,Ethanol: 10 mg/ml
- Aggregatzustand
- A neat oil
- Farbe
- Colorless to light yellow
- Henry's Law Constant
- 1.5 · 1.5×100 mol/(m3Pa) at 25℃, Ebert et al. (2023)
- Stabilität
- Light Sensitive
- InChI
- InChI=1S/C19H34O3/c1-15(2)22-18(20)14-17(4)11-8-10-16(3)12-9-13-19(5,6)21-7/h8,11,14-16H,9-10,12-13H2,1-7H3/b11-8+,17-14+/t16-/m1/s1
- InChIKey
- NFGXHKASABOEEW-GYMWBFJFSA-N
- SMILES
- C(OC(C)C)(=O)/C=C(\C)/C=C/C[C@@H](C)CCCC(OC)(C)C
- EPA chemische Informationen
- S-Methoprene (65733-16-6)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410: Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
P273, P391, and P501 (click each P-code to see the statement)
Warning
Gefahrenhinweise
Regulatory Informations-Methoprene: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety Information
IMAP assessments - 2,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, 1-methylethyl ester, (S-(E,E))-: Environment tier I assessment；IMAP assessments - 2,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, 1-methylethyl ester, (S-(E,E))-: Human health tier I assessment
Hazard Classes and Categories
Skin Irrit. 2 (16.7%)；STOT SE 3 (16.7%)；Aquatic Acute 1 (100%)；Aquatic Chronic 1 (66.7%)
Hazardous to the aquatic environment (acute) - category 1；Hazardous to the aquatic environment (chronic) - category 1
Aquatic Acute 1；Aquatic Chronic 1
Regulatorische Informationen
Regulatory Informations-Methoprene: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Sicherheitsdaten
- hs_code
- 2918999090
- hazard_code
- Xi
- hazard_note
- Irritant
Chemie und Industrie
Verwendung und Herstellung
Household ProductsInformation on 121 consumer products that contain d-Methoprene in the following categories is provided:；• Inside the Home；• Landscaping/Yard；• Pet Care
Anwendungen
Beschreibung(S)-(+)-Methoprene is a widely-used insect growth regulator. It is remarkable for its lack of significant effects against a wide variety of mammals, although concerns remain for its effects on arthropod development. Methoprene acts as an activator of the juvenile hormone receptor, known as Methoprene-tolerant or Met (Kd = 12.3 nM). Met is a transcription factor that, upon activation with juvenile hormone or methoprene, regulates gene expression that inhibits metamorphosis.
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