Grundinformationen
- CAS
19881-18-6- Standard-SMILES
O=[N+]([O-])c1ccc(Oc2ccc(N=C=S)cc2)cc1- InChIKey
SVMGVZLUIWGYPH-UHFFFAOYSA-N- Summenformel
- C13H8N2O3S
- Durchschnittliche Molmasse
- 272,28 g/mol
- Monoisotopische Masse
- 272,0255633
Namen und Bezeichner
- Bevorzugter Name
- Nitroscanate
- IUPAC
- 1-isothiocyanato-4-(4-nitrophenoxy)benzene
- Lokaler Name
- Nitroscanat
- Englischer Name
- 4-Isothiocyanato-4'-nitrodiphenyl ether
- Summenformel
- C13H8N2O3S
- Molmasse
- 272.28
Namen und Synonyme
Nitroscanate19881-18-6LopatolBenzene, 1-isothiocyanato-4-(4-nitrophenoxy)-NitroscanatoNitroscanatumCGA-23654DTXSID9048772P4IE5B6D6UDTXCID20286984-nitro-4'-isothiocyanodiphenyl etherRefChem:854368
Weitere Namen anzeigen
lopydolCGA-23654GSNimesulide Impurity 7Nitroscanate USP/EP/BPNimesulide Impurity 12Racanisodamine USP/EP/BP
243-393-64-Isothiocyanato-4'-nitrodiphenyl etherCantrodifene1-isothiocyanato-4-(4-nitrophenoxy)benzenep-(p-Nitrophenoxy)phenyl isothiocyanate1-(4-Isothiocyanatophenoxy)-4-nitrobenzeneMFCD00060545NCGC00182049-01
Datenbank-Bezeichner
- CAS
19881-18-6- PubChem CID
- 68547
- DTXSID
DTXSID9048772- ChEMBL
CHEMBL304432- UNII
- P4IE5B6D6U
- EC Number
- 243-393-6
- Nikkaji
- J11.029I
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 5,1
- Polarare Oberfläche (TPSA)
- 99,5 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 19
- Formalladung
- 0
- Komplexität
- 349
Physikochemische Eigenschaften
- Schmelzpunkt
- 122 °C · 122 °C
- Siedepunkt
- 202 °C · 202°C (rough estimate)
- Dichte
- 1.3946 · 1.3946 (rough estimate)
- Brechungsindex
- 1.636 · 1.6360 (estimate)
- Löslichkeit
- Chloroform (Slightly), DMSO (Slightly)
- Aggregatzustand
- Solid
- Farbe
- Pale Yellow to Pale Beige
- Stabilität
- Hygroscopic, Moisture Sensitive
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 2.3% (1 of 43) of reports.
Warning
H319 (95.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H411 (90.7%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P264+P265, P273, P280, P305+P351+P338, P337+P317, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 1 of 43 reports by companies.；There are 4 notifications provided by 42 of 43 reports by companies with hazard statement code(s).；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 InformationChemical: Benzene, 1-isothiocyanato-4-(4-nitrophenoxy)-
Hazard Classes and CategoriesEye Irrit. 2 (95.3%)；Aquatic Chronic 2 (90.7%)
Regulatorische Informationen
Regulatory InformationChemical: Benzene, 1-isothiocyanato-4-(4-nitrophenoxy)-
Sicherheitsdaten
- ridadr
Chemie und Industrie
Pharmakologische Informationen
ATC CodeQP - Antiparasitic products, insecticides and repellents；QP52 - Anthelmintics；QP52A - Anthelmintics；QP52AX - Other anthelmintic agents；QP52AX01 - Nitroscanate
Anwendungen
VerwendenAnthelmintic (veterinary).
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter29 Anbieter
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怀化元研达生物技术有限责任公司18711085600 · [email protected]
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