HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 235713Erstellt: 24. Oktober 2026
4-Amino-2-nitrobenzoic Acid
4-AMINO-2-NITROBENZOIC ACID · 4-Amino-2-nitrobenzoicAcid>4-azanyl-2-nitro-benzoic acid · Benzoic acid, 4-amino-2-nitro-
https://huagongshe.com/de/chemical/235713
Identifikatoren & physikalische Daten
| CAS No. | 610-36-6 |
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| Summenformel | C7H6N2O4 |
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| Durchschnittliche Molmasse | 182,13 g/mol |
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| Monoisotopische Masse | 182,03275667 g/mol |
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| SMILES | Nc1ccc(C(=O)O)c([N+](=O)[O-])c1 |
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| InChIKey | SAJYSJVBNGUWJK-UHFFFAOYSA-N |
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| PubChem CID | 235713 |
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| ChEMBL | CHEMBL3278351 |
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| EC No. | 674-598-2 |
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| DTXSID | DTXSID70284476 |
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Chemische & physikalische Eigenschaften
| XLogP | 0,8 |
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| Polarare Oberfläche (TPSA) | 109 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 1 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 225 |
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| LogP (Verteilungskoeffizient) | 1.21 |
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| Schmelzpunkt | 239 °C |
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| Siedepunkt | 440.9±35.0 °C(Predicted) |
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| Dichte | 1.568±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | Keep in dark place,Inert atmosphere,Room temperature |
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| Aggregatzustand | powder to crystal |
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| pKa (Säurekonstante) | 2.84±0.25(Predicted) |
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| Farbe | Light yellow to Amber to Dark green |
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| CAS Datenbank | 610-36-6(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (25%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | Acute Tox. 4 (25%) |
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| Zollcode | 2922.49.3700 |
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| Gefahrenklasse | IRRITANT |
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