HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 69161Erstellt: 26. Oktober 2026
N-(Carboxymethyl)anthranilsure
RMA-329 · NSC 80600 · AKOS AU36-M366 · AKOS BBS-00007771 · TIMTEC-BB SBB006542 · anthranilidoacetic acid · Anthranilinoacetic acid · N-(CARBOXYPHENYL)GLYCINE
https://huagongshe.com/de/chemical/69161
Identifikatoren & physikalische Daten
| CAS No. | 612-42-0 |
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| Summenformel | C9H9NO4 |
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| Durchschnittliche Molmasse | 195,17 g/mol |
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| Monoisotopische Masse | 195,05315777 g/mol |
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| SMILES | O=C(O)CNc1ccccc1C(=O)O |
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| InChIKey | PJUXPMVQAZLJEX-UHFFFAOYSA-N |
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| PubChem CID | 69161 |
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| ChEMBL | CHEMBL443231 |
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| EC No. | 210-311-5 |
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| DTXSID | DTXSID9060609 |
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| Lokaler Name | N-(Carboxymethyl)anthranilsure |
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Chemische & physikalische Eigenschaften
| XLogP | 1,7 |
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| Polarare Oberfläche (TPSA) | 86,6 |
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| H-Brücken-Donoren | 3 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 4 |
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| Schwere Atome | 14 |
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| Formalladung | 0 |
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| Komplexität | 229 |
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| Löslichkeit | >29.3 [ug/mL] (The mean of the results at pH 7.4) |
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| Schmelzpunkt | 218 °C (dec.)(lit.) |
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| Siedepunkt | 218°C |
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| Dichte | 1.472 |
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| Brechungsindex | 1.5700 (estimate) |
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| Flammpunkt | 218°C/ |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| Aggregatzustand | Crystalline Powder |
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| pKa (Säurekonstante) | 3+-.0.36(Predicted) |
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| Farbe | Light yellow to yellow |
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| CAS Datenbank | 612-42-0(CAS DataBase Reference) |
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| EPA chemische Informationen | Benzoic acid, 2-[(carboxymethyl)amino]- (612-42-0) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatorische Informationen | REACH registered substance: N-(carboxymethyl)anthranilic acid (EC: 210-311-5) |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| TSCA-Inventar-Status | TSCA listed |
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| Zollcode | 29224985 |
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| R-Sätze (R) | 36/37/38 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 26-37/39 |
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| Gefahrenklasse | IRRITANT |
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