HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 237413Erstellt: 24. Oktober 2026
trans-2-Phenylcyclopropanecarboxylic acid
(1R,2R)-2-Phenylcyclopropanecarboxylic acid · (1R)-2α-Phenylcyclopropane-1β(1R)-2α-Phenylcyclopropane-1β-carboxylic acid · Cyclopropanecarboxylic acid, 2-phenyl-, (1R,2R)- · (1R,2R)-2-phenylcyclopropane-1-carboxylic acid - [P86540]
https://huagongshe.com/de/chemical/237413
Identifikatoren & physikalische Daten
| CAS No. | 3471-10-1 |
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| Summenformel | C10H10O2 |
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| Durchschnittliche Molmasse | 162,18 g/mol |
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| Monoisotopische Masse | 162,06807956 g/mol |
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| SMILES | O=C(O)[C@@H]1C[C@H]1c1ccccc1 |
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| InChIKey | AHDDRJBFJBDEPW-DTWKUNHWSA-N |
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| PubChem CID | 237413 |
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| ChEBI | CHEBI:79920 |
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| EC No. | 213-366-3 |
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| DTXSID | DTXSID301272871 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,6 |
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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 | 12 |
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| Formalladung | 0 |
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| Komplexität | 182 |
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| Schmelzpunkt | 92 °C |
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| Siedepunkt | 317.1±31.0 °C(Predicted) |
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| Dichte | 1.250±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | Sealed in dry,Room Temperature |
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| pKa (Säurekonstante) | 4.57±0.10(Predicted) |
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| InChI | InChI=1S/C10H10O2/c11-10(12)9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6H2,(H,11,12)/t8-,9+/m0/s1 |
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| InChIKey | AHDDRJBFJBDEPW-DTWKUNHWSA-N |
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| SMILES | [C@@H]1(C(O)=O)C[C@H]1C1=CC=CC=C1 |
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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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| Regulatorische Informationen | Cyclopropanecarboxylic acid, 2-phenyl-, (1R,2R)-rel-: Does not have an individual approval but may be used under an appropriate group standard |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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| Alarmwort | Warnung |
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| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
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