HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 12373866Erstellt: 1. November 2026
2-(4-(4-Chlorophenyl)-2-(methylamino)-1,3-thiazol-5-yl)acetic acid
T5920198 · 5-Thiazoleacetic acid, 4-(4-chlorophenyl)-2-(methylamino)- · [4-(4-Chloro-phenyl)-2-methylamino-thiazol-5-yl]-acetic acid · [4-(4-chlorophenyl)-2-(methylamino)-1,3-thiazol-5-yl]acetic acid · 2-[4-(4-Chlorophenyl)-2-(methylamino)-1,3-thiazol-5-yl]acetic acid
https://huagongshe.com/de/chemical/12373866
Identifikatoren & physikalische Daten
| CAS No. | 751427-39-1 |
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| Summenformel | C12H11ClN2O2S |
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| Durchschnittliche Molmasse | 282,75 g/mol |
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| Monoisotopische Masse | 282,0229765 g/mol |
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| SMILES | CNc1nc(-c2ccc(Cl)cc2)c(CC(=O)O)s1 |
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| InChIKey | CLEOENHXLJXIBB-UHFFFAOYSA-N |
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| PubChem CID | 12373866 |
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| EC No. | 996-105-2 |
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Chemische & physikalische Eigenschaften
| XLogP | 3,1 |
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| Polarare Oberfläche (TPSA) | 90,5 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 4 |
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| Schwere Atome | 18 |
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| Formalladung | 0 |
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| Komplexität | 298 |
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| Siedepunkt | 493.3±55.0 °C(Predicted) |
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| Dichte | 1.440±0.06 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 3.83±0.10(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): 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)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%) |
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| Gefahrenklasse | IRRITANT |
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