HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 99816Erstellt: 27. Oktober 2026
2-Cyclohexylpropionsure
2-Cyclohexylpropanoic acid · NSC-225250 · Einecs 227-956-3 · 2-cyclohexylpropionic acid · α-Methylcyclohexaneacetic acid · Cyclohexaneacetic acid, α-methyl- · 2-cyclohexylpropanoic acid(SALTDATA: FREE)
https://huagongshe.com/de/chemical/99816
Identifikatoren & physikalische Daten
| CAS No. | 6051-13-4 |
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| Summenformel | C9H16O2 |
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| Durchschnittliche Molmasse | 156,22 g/mol |
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| Monoisotopische Masse | 156,11502975 g/mol |
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| SMILES | CC(C(=O)O)C1CCCCC1 |
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| InChIKey | VRLUSLNMNQAPOH-UHFFFAOYSA-N |
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| PubChem CID | 99816 |
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| EC No. | 227-956-3 |
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| DTXSID | DTXSID301310992 |
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| Lokaler Name | 2-Cyclohexylpropionsure |
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Chemische & physikalische Eigenschaften
| XLogP | 3 |
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| Polarare Oberfläche (TPSA) | 37,3 |
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| H-Brücken-Donoren | 1 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 2 |
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| Schwere Atome | 11 |
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| Formalladung | 0 |
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| Komplexität | 136 |
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| Schmelzpunkt | 62 °C |
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| Siedepunkt | 120-121 °C(Press: 4.7 Torr) |
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| Dichte | 1.0270 g/cm3 |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| pKa (Säurekonstante) | 4.79±0.10(Predicted) |
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| LogP (Verteilungskoeffizient) | 2.650 (est) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 2 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 (100%) |
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| Gefahrenklasse | IRRITANT |
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