HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 60136498Erstellt: 28. Oktober 2026
2-(4-chloro-1-ethyl-1H-pyrazol-5-yl)acetic acid
1H-Pyrazole-5-acetic acid, 4-chloro-1-ethyl- · 2-(4-chloro-2-ethyl-pyrazol-3-yl)acetic acid · (4-chloro-1-ethyl-1H-pyrazol-5-yl)acetic acid · 2-(4-Chloro-1-ethyl-1h-pyrazol-5-yl)acetic acid
https://huagongshe.com/de/chemical/60136498
Identifikatoren & physikalische Daten
| CAS No. | 1310379-51-1 |
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| Summenformel | C7H9ClN2O2 |
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| Durchschnittliche Molmasse | 188,61 g/mol |
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| Monoisotopische Masse | 188,0352552 g/mol |
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| SMILES | CCn1ncc(Cl)c1CC(=O)O |
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| InChIKey | SCKWUXFHEBFXOR-UHFFFAOYSA-N |
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| PubChem CID | 60136498 |
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| EC No. | 986-204-9 |
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Chemische & physikalische Eigenschaften
| XLogP | 0,7 |
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| Polarare Oberfläche (TPSA) | 55,1 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 3 |
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| Frei drehbare Bindungen | 3 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 177 |
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| Siedepunkt | 344.4±27.0 °C(Predicted) |
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| Dichte | 1.39±0.1 g/cm3(Predicted) |
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| pKa (Säurekonstante) | 3.77±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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