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HCID 9348Erstellt: 24. Oktober 2026
3-Phenylsalicylsure
m-phenyl · USAF do-59 · Phenylsalicylicacid · 3-phenyl-salicylicaci · m-phenylsalicylicacid · m-Phenylsalicylic acid · 3-Phenylsalicylic acid · 3-PhenylsalicylicAcid>Salicylic acid, 3-phenyl-
https://huagongshe.com/de/chemical/9348
Identifikatoren & physikalische Daten
| CAS No. | 304-06-3 |
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| Summenformel | C13H10O3 |
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| Durchschnittliche Molmasse | 214,22 g/mol |
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| Monoisotopische Masse | 214,06299418 g/mol |
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| SMILES | O=C(O)c1cccc(-c2ccccc2)c1O |
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| InChIKey | ZJWUEJOPKFYFQD-UHFFFAOYSA-N |
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| PubChem CID | 9348 |
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| ChEMBL | CHEMBL229466 |
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| EC No. | 206-148-4 |
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| DTXSID | DTXSID1059787 |
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| Lokaler Name | 3-Phenylsalicylsure |
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Chemische & physikalische Eigenschaften
| XLogP | 4,1 |
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| Polarare Oberfläche (TPSA) | 57,5 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 16 |
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| Formalladung | 0 |
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| Komplexität | 246 |
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| Schmelzpunkt | 186°C |
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| Siedepunkt | 314.35°C (rough estimate) |
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| Dichte | 1.2500 |
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| Brechungsindex | 1.5090 (estimate) |
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| Lagerbedingungen | Hygroscopic, -20°C Freezer, Under inert atmosphere |
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| Löslichkeit | DMSO (Slightly), Methanol (Slightly) |
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| Aggregatzustand | Solid |
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| pKa (Säurekonstante) | 2.84±0.10(Predicted) |
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| Farbe | White to Off-White |
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| Stabilität | Hygroscopic |
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| EPA chemische Informationen | [1,1'-Biphenyl]-3-carboxylic acid, 2-hydroxy- (304-06-3) |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (97.6%): Harmful if swallowed [Warning Acute toxicity, oral]P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 41 reports by companies from 3 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 (97.6%) |
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| TSCA-Inventar-Status | TSCA listed |
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| Zollcode | 2918.29.7500 |
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| RTECS-Nr. | VO5600000 |
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| Sicherheitshinweise (S) | 22-24/25 |
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