HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 79071Erstellt: 27. Oktober 2026
Ethyl-2-bromvalerat
ETHYL 2-BROMOPENTANOATE · 2-bromovaL · 2-Ethyl bromoate · ETHYL 2-BROMOVALERATE · Ethyl2-Bromovalerate>DL-ETHYL 2-BROMOVALERATE · Ethyl2-bromovalerate,97% · Ethyl alpha-bromovalerate · Ethyl 2-broMovalerate, 98%+
https://huagongshe.com/de/chemical/79071
Identifikatoren & physikalische Daten
| CAS No. | 112889-44-8 |
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| Summenformel | C7H13BrO2 |
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| Durchschnittliche Molmasse | 209,08 g/mol |
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| SMILES | CCCC(Br)C(=O)OCC |
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| InChIKey | ORSIRXYHFPHWTN-UHFFFAOYSA-N |
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| PubChem CID | 79071 |
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| EC No. | 210-450-1 |
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| DTXSID | DTXSID10862292 |
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| Lokaler Name | Ethyl-2-bromvalerat |
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Chemische & physikalische Eigenschaften
| XLogP | 2,6 |
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| Polarare Oberfläche (TPSA) | 26,3 |
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| H-Brücken-Donoren | 0 |
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| H-Brücken-Akzeptoren | 2 |
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| Frei drehbare Bindungen | 5 |
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| Schwere Atome | 10 |
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| Formalladung | 0 |
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| Komplexität | 104 |
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| SpringerMaterials Properties | Optical coefficient |
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| Siedepunkt | 190-192 °C(lit.) |
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| Dichte | 1.226 g/mL at 25 °C(lit.) |
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| Brechungsindex | n20/D 1.448(lit.) |
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| Flammpunkt | 171 °F |
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| Lagerbedingungen | Inert atmosphere,Room Temperature |
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| Löslichkeit | Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)insoluble |
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| Aggregatzustand | Liquid |
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| Wichte | 1.22 |
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| Farbe | Clear colorless |
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| BRN | 1098901 |
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| InChI | InChI=1S/C7H13BrO2/c1-3-5-6(8)7(9)10-4-2/h6H,3-5H2,1-2H3 |
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| InChIKey | ORSIRXYHFPHWTN-UHFFFAOYSA-N |
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| SMILES | C(OCC)(=O)C(Br)CCC |
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| CAS Datenbank | 615-83-8(CAS DataBase Reference) |
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| NIST chemische Informationen | Ethyl 2-bromovalerate(615-83-8) |
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Sicherheit & Vorschriften
| GHS-Einstufung | DangerH314 (97.8%): 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 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatorische Informationen | Chemical: Pentanoic acid, 2-bromo-, ethyl esterEthyl 2-bromovalerate: Does not have an individual approval but may be used under an appropriate group standard |
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| Hazard Classes and Categories | Skin Corr. 1B (97.8%) |
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| Wassergefährdungsklasse (WGK) | 3 |
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| UN-Transportnummer | UN 3265 8/PG 2 |
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| Zollcode | 29159080 |
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| R-Sätze (R) | 34-36/37-36/37/38 |
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| Gefahrensymbole | C,Xi |
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| Sicherheitshinweise (S) | 23-26-27-36/37/39-45-24/25 |
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| Gefahrenklasse | 8Eye Dam. 1Skin Corr. 1BSTOT SE 3 |
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| Verpackungsgruppe | III |
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| Lagerklasse | 8A - Combustible corrosive hazardous materials |
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