5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-1H-pyrazole-3-carbonitrile

HCID 3303913
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Grundinformationen

CAS
120068-79-3
Standard-SMILES
N#Cc1cc(N)n(-c2c(Cl)cc(C(F)(F)F)cc2Cl)n1
InChIKey
QPZYPAMYHBOUTC-UHFFFAOYSA-N
Summenformel
C11H5Cl2F3N4
Durchschnittliche Molmasse
321,08 g/mol
Monoisotopische Masse
319,9843361

Namen und Bezeichner

Bevorzugter Name
5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-1H-pyrazole-3-carbonitrile
IUPAC
5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazole-3-carbonitrile
Englischer Name
5-Amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl)pyrazole
Summenformel
C11H5Cl2F3N4
Molmasse
321.09

Namen und Synonyme

120068-79-35-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-1H-pyrazole-3-carbonitrile5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-carbonitrileEC 421-240-6DTXSID20391260RefChem:101893DTXCID70342121421-240-65-Amino-3-cyano-1-(2,6-dichloro-4-trifluoromethylphenyl)pyrazole5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazole-3-carbonitrileMFCD002275375-Amino-1-(2,6-dichloro-4-trifluoromethylphenyl)-3-cycano pyrazole
Weitere Namen anzeigen
5-Amino-3-cyano-(2,6-dichloro-4-trifluoromethyl-phenyl)pyrazolePyrazole ringPyrazole coreArylpyrazolenitrile5-Amino-3-cyano-1-(2FIPRONIL INTERMEDIATEtrifluoromethyl)phenyl]-1H-pyrazole6-dichloro-4-trifluoromethylphenyl)pyrazole
Fipronil Detrifluoromethylsulfinyl5-Amino-3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazoleC11H5Cl2F3N41H-Pyrazole-3-carbonitrile, 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-Amino-3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]pyrazol5-Amino-3-cyano-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-1H-pyrazoleSCHEMBL239495SCHEMBL2421794

Datenbank-Bezeichner

CAS
120068-79-3
PubChem CID
3303913
DTXSID
DTXSID20391260
EC Number
421-240-6、601-665-5
Nikkaji
J2.346.339C

Eigenschaften

Berechnete Struktureigenschaften

XLogP
3,7
Polarare Oberfläche (TPSA)
67,6 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
6
Frei drehbare Bindungen
1
Schwere Atome
20

Physikochemische Eigenschaften

Schmelzpunkt
132 · 132-141 °C
Siedepunkt
433 · 433.0±45.0 °C(Predicted)
Dichte
1.65 · 1.65±0.1 g/cm3(Predicted)
storage temp.
2 · under inert gas (nitrogen or Argon) at 2–8 °C
Löslichkeit
Chloroform (Slightly), Methanol (Slightly)
Aggregatzustand
Solid

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P273, P391, and P501 (click each P-code to see the statement)

Warning

H302+H312+H332 (33.3%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]；H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

Gefahrenhinweise

Regulatory InformationStatus: Active Update: 30-06-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/19660；Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/8495
Hazard Classes and Categories · 3 Einträge

Acute Tox. 4 (33.3%)；Acute Tox. 4 (33.3%)；Skin Irrit. 2 (33.3%)；Eye Irrit. 2 (33.3%)；Acute Tox. 4 (33.3%)；Aquatic Chronic 2 (100%)

Hazardous to the aquatic environment (chronic) - category 2

Aquatic Chronic 2

Regulatorische Informationen

Regulatory InformationStatus: Active Update: 30-06-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/19660；Status: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/8495

Sicherheitsdaten

hs_code
2933.19.4300

Chemie und Industrie

Anwendungen

VerwendenFipronil Detrifluoromethylsulfinyl is an intermediate in the synthesis of Fipronil (F342200), which is a GABA receptor antagonists and insecticides.

Vor- und nachgelagerte Produkte

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湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
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]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]

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