HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 3878539Erstellt: 27. Oktober 2026
4-Phenylthiazole-2-carboxylic acid
CHEMBRDG-BB 4401055 · 4-phenyl-2-thiazolecarboxylic acid · 4-PHENYL-THIAZOLE-2-CARBOXYLIC ACID · 2-Thiazolecarboxylic acid,4-phenyl- · 4-PHENYL-1,3-THIAZOLE-2-CARBOXYLIC ACID · JR-14104, 4-Phenylthiazole-2-carboxylic acid, 97% · 4-phenyl-1,3-thiazole-2-carboxylic acid(SALTDATA: FREE)
https://huagongshe.com/de/chemical/3878539
Identifikatoren & physikalische Daten
| CAS No. | 59020-44-9 |
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| Summenformel | C10H7NO2S |
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| Durchschnittliche Molmasse | 205,23 g/mol |
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| Monoisotopische Masse | 205,01974946 g/mol |
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| SMILES | O=C(O)c1nc(-c2ccccc2)cs1 |
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| InChIKey | ORSGNNVYFOPYKB-UHFFFAOYSA-N |
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| PubChem CID | 3878539 |
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| ChEMBL | CHEMBL4586011 |
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| EC No. | 886-536-3 |
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| DTXSID | DTXSID50397710 |
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Chemische & physikalische Eigenschaften
| XLogP | 2,5 |
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| Polarare Oberfläche (TPSA) | 78,4 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 4 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 14 |
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| Formalladung | 0 |
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| Komplexität | 216 |
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| Lagerbedingungen | Sealed in dry,Store in freezer, under -20°C |
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| Aggregatzustand | crystalline powder |
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| Farbe | White |
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| InChI | 1S/C10H7NO2S/c12-10(13)9-11-8(6-14-9)7-4-2-1-3-5-7/h1-6H,(H,12,13) |
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| InChIKey | ORSGNNVYFOPYKB-UHFFFAOYSA-N |
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| SMILES | OC(=O)c1nc(cs1)-c2ccccc2 |
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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)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Wassergefährdungsklasse (WGK) | WGK 3 |
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| Zollcode | 2934100090 |
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| R-Sätze (R) | 22 |
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| Gefahrensymbole | Xn |
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| Gefahrenklasse | IRRITANTAcute Tox. 4 Oral |
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| Lagerklasse | 11 - Combustible Solids |
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