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HCID 4377749Erstellt: 26. Oktober 2026

1-(3-Chloro-propenyl)-3-nitro-benzene

1-(3-CHLORO-PROPENYL)-3-NITRO-BENZENE · 1-[(1E)-3-chloroprop-1-en-1-yl]-3-nitrobenzene

https://huagongshe.com/de/chemical/4377749

Molekülstruktur von 1-(3-Chloro-propenyl)-3-nitro-benzene

Identifikatoren & physikalische Daten

CAS No.2016-83-3
SummenformelC9H8ClNO2
Durchschnittliche Molmasse197,62 g/mol
Monoisotopische Masse197,0243562 g/mol
SMILESO=[N+]([O-])c1cccc(C=CCCl)c1
InChIKeyVYHWMGGPQOROGN-UHFFFAOYSA-N
PubChem CID4377749
EC No.654-603-4

Chemische & physikalische Eigenschaften

XLogP2,6
Polarare Oberfläche (TPSA)45,8
H-Brücken-Donoren0
H-Brücken-Akzeptoren2
Frei drehbare Bindungen2
Schwere Atome13
Formalladung0
Komplexität200
Schmelzpunkt74-75 °C
Siedepunkt324.721±30.00 °C(Press: 760.00 Torr)(predicted)
Dichte1.286±0.06 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted)

Sicherheit & Vorschriften

GHS-EinstufungWarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, 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. 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.
Hazard Classes and CategoriesAcute Tox. 4 (100%)Skin Sens. 1 (100%)
AlarmwortWarnung
GefahrenhinweiseCode Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302