HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 279983Erstellt: 27. Oktober 2026
4-(4-Hydroxyphenyl)butanoic acid
4-(4-HYDROXYPHENYL)B · 4-Carboxypropylphenol · P-HYDOROXYPHENYLBUTANOIC ACID · 4-Hydroxy-benzenebutanoic acid · 4-(4-HYDROXYPHENYL)BUTYRIC ACID · Benzenebutanoic acid, 4-hydroxy- · 4-(4-HYDROXYPHENYL)BUTANOIC ACID
https://huagongshe.com/de/chemical/279983
Identifikatoren & physikalische Daten
| CAS No. | 7021-11-6 |
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| Summenformel | C10H12O3 |
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| Durchschnittliche Molmasse | 180,2 g/mol |
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| Monoisotopische Masse | 180,07864424 g/mol |
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| SMILES | O=C(O)CCCc1ccc(O)cc1 |
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| InChIKey | WTDBNDAYNLGKGW-UHFFFAOYSA-N |
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| PubChem CID | 279983 |
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| ChEMBL | CHEMBL4097450 |
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| EC No. | 615-082-9 |
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| DTXSID | DTXSID20299550 |
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Chemische & physikalische Eigenschaften
| XLogP | 2 |
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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 | 4 |
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| Schwere Atome | 13 |
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| Formalladung | 0 |
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| Komplexität | 160 |
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| Schmelzpunkt | 110-111 °C |
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| Siedepunkt | 128-200 °C(Press: 0.4 Torr) |
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| Dichte | 1.214±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | Inert atmosphere,Room Temperature |
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| Löslichkeit | Chloroform (Slightly), DMSO (slightly) |
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| Aggregatzustand | Solid |
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| pKa (Säurekonstante) | 4.78±0.10(Predicted) |
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| Farbe | White to Off-White |
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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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| Zollcode | 2918290090 |
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