HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 52273Erstellt: 3. November 2026
Benzonitrile, 2,5-dimethyl-4-nitro-
2,4-dimethyl-5-nitrobenzonitrile · 2,5-Dimethyl-4-nitrobenzonitrile · Benzonitrile, 2,5-dimethyl-4-nitro-
https://huagongshe.com/de/chemical/52273
Identifikatoren & physikalische Daten
| CAS No. | 73713-69-6 |
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| Summenformel | C9H8N2O2 |
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| Durchschnittliche Molmasse | 176,17 g/mol |
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| Monoisotopische Masse | 176,0585775 g/mol |
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| SMILES | Cc1cc([N+](=O)[O-])c(C)cc1C#N |
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| InChIKey | AIJHILQDGSFDQP-UHFFFAOYSA-N |
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| PubChem CID | 52273 |
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| EC No. | 822-931-9 |
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| DTXSID | DTXSID50224017 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,2 |
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| Polarare Oberfläche (TPSA) | 69,6 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 0 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 250 |
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| Schmelzpunkt | 117-118 °C |
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| Siedepunkt | 342.434±30.00 °C(Press: 760.00 Torr)(predicted) |
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| Dichte | 1.221±0.10 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted) |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Acute Tox. 4 (100%)Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%) |
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| Zollcode | 2926907090 |
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