HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 548221Erstellt: 26. Oktober 2026
9-Bromononanoic Acid
9-Bromononoic Acid · 9-BROMONONANOIC ACID · Nonanoic acid, 9-bromo- · 9-BROMO-N-NONANOIC ACID · 9-Bromononanoic Acid >9-Bromononanoic acid 98% · 9-Bromononanoic acid, tech · 9 - bromine pelargonic acid
https://huagongshe.com/de/chemical/548221
Identifikatoren & physikalische Daten
| CAS No. | 41059-02-3 |
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| Summenformel | C9H17BrO2 |
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| Durchschnittliche Molmasse | 237,13 g/mol |
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| Monoisotopische Masse | 236,04119188 g/mol |
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| SMILES | O=C(O)CCCCCCCCBr |
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| InChIKey | XEGRKZRPTBNSMN-UHFFFAOYSA-N |
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| PubChem CID | 548221 |
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| EC No. | 676-389-1 |
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| DTXSID | DTXSID30338303 |
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Chemische & physikalische Eigenschaften
| XLogP | 1,9 |
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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 | 8 |
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| Schwere Atome | 12 |
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| Formalladung | 0 |
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| Komplexität | 115 |
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| Lipide | Fatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Halogenated fatty acids [FA0109] |
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| Schmelzpunkt | 39°C |
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| Siedepunkt | 165°C/3mm |
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| Dichte | 1.282±0.06 g/cm3(Predicted) |
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| Lagerbedingungen | Sealed in dry,2-8°C |
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| Löslichkeit | Chloroform (Soluble), 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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| InChI | InChI=1S/C9H17BrO2/c10-8-6-4-2-1-3-5-7-9(11)12/h1-8H2,(H,11,12) |
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| InChIKey | XEGRKZRPTBNSMN-UHFFFAOYSA-N |
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| SMILES | C(O)(=O)CCCCCCCCBr |
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| CAS Datenbank | 41059-02-3(CAS DataBase Reference) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH290 (33.3%): May be corrosive to metals [Warning Corrosive to Metals]P234, P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P332+P317, P337+P317, P362+P364, P363, P390, P403+P233, P405, P406, 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 | Met. Corr. 1 (33.3%) |
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| UN-Transportnummer | 3261 |
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| Zollcode | 2916399090 |
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| R-Sätze (R) | 34 |
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| Gefahrensymbole | Xi |
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| Sicherheitshinweise (S) | 36/37/39 |
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| Gefahrenklasse | IRRITANT |
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| Verpackungsgruppe | III |
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