HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 4642003Erstellt: 5. November 2026
Spiro(2.3)hexane-1-carboxylic Acid
CHEMBRDG-BB 4003535 · 1-Carboxyspiro[2.3]hexane · Spiro[2.3]hexane-1-carboxylic acid · rac-(R)-spiro[2.3]hexane-1-carboxylic acid
https://huagongshe.com/de/chemical/4642003
Identifikatoren & physikalische Daten
| CAS No. | 17202-56-1 |
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| Summenformel | C7H10O2 |
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| Durchschnittliche Molmasse | 126,15 g/mol |
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| Monoisotopische Masse | 126,06807956 g/mol |
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| SMILES | O=C(O)C1CC12CCC2 |
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| InChIKey | VVSCGNLRDCLHAN-UHFFFAOYSA-N |
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| PubChem CID | 4642003 |
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| EC No. | 696-352-3 |
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| DTXSID | DTXSID80405150 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,4 |
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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 | 1 |
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| Schwere Atome | 9 |
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| Formalladung | 0 |
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| Komplexität | 158 |
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| Siedepunkt | 239.9±8.0 °C(Predicted) |
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| Dichte | 1.22±0.1 g/cm3(Predicted) |
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| Lagerbedingungen | Storage temp. 2-8°C |
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| pKa (Säurekonstante) | 4.83±0.20(Predicted) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 3 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 | Skin Corr. 1B (100%) |
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| Zollcode | 2916399090 |
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| R-Sätze (R) | 22-36/37/38 |
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| Gefahrensymbole | Xi,Xn |
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| hazard_note | Irritant |
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| Sicherheitshinweise (S) | 26 |
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