Grundinformationen
- Standard-SMILES
CCNc1ccc(C(N)=O)cc1[N+](=O)[O-]- InChIKey
JJDONAVASZMYRM-UHFFFAOYSA-N- Summenformel
- C9H11N3O3
- Durchschnittliche Molmasse
- 209,2 g/mol
- Monoisotopische Masse
- 209,08004122
Namen und Bezeichner
- Bevorzugter Name
- 4-Ethylamino-3-nitrobenzamide
- IUPAC
- 4-(ethylamino)-3-nitrobenzamide
Namen und Synonyme
4-ETHYLAMINO-3-NITROBENZAMIDERefChem:522842653-486-762306-06-34-(ethylamino)-3-nitrobenzamideBenzamide, 4-(ethylamino)-3-nitro-SCHEMBL5674224DTXSID90395336JJDONAVASZMYRM-UHFFFAOYSA-N3-nitro-4-(N-ethylamino)-benzamideAKOS008922737
Datenbank-Bezeichner
- CAS
62306-06-3- PubChem CID
- 3708922
- DTXSID
DTXSID90395336- EC Number
- 653-486-7
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,6
- Polarare Oberfläche (TPSA)
- 101 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 15
- Formalladung
- 0
- Komplexität
- 251
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.；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 CategoriesSkin Sens. 1 (100%)
Zugehörige Reaktionen
3
Verknüpfte Notizen
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