HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 954261Erstellt: 27. Oktober 2026
Ethyl 4-(bromomethyl)benzoate
ETHYL 4-(BROMOMETHYL)BENZOATE · 4-ethoxycarbonylbenzyl bromide · 4-(methyl bromide) ethyl benzoate · 4-(BROMOMETHYL)BENZOIC ACID ETHYL ESTER · Benzoic acid, 4-(bromomethyl)-, ethyl ester · ETHYL (4-BROMOMETHYL) BENZOATE (SB290160007) · 4-(Bromomethyl)benzoic acid ethyl ester~4-Ethoxycarbonylbenzyl bromide · 4-(Ethoxycarbonyl)benzyl bromide, alpha-Bromo-4-(ethoxycarbonyl)toluene
https://huagongshe.com/de/chemical/954261
Identifikatoren & physikalische Daten
| CAS No. | 26496-94-6 |
|---|
| Summenformel | C10H11BrO2 |
|---|
| Durchschnittliche Molmasse | 243,1 g/mol |
|---|
| Monoisotopische Masse | 241,99424 g/mol |
|---|
| SMILES | CCOC(=O)c1ccc(CBr)cc1 |
|---|
| InChIKey | TWQLMAJROCNXEA-UHFFFAOYSA-N |
|---|
| PubChem CID | 954261 |
|---|
| EC No. | 607-949-5 |
|---|
| DTXSID | DTXSID00359262 |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 3,2 |
|---|
| Polarare Oberfläche (TPSA) | 26,3 |
|---|
| H-Brücken-Donoren | 0 |
|---|
| H-Brücken-Akzeptoren | 2 |
|---|
| Frei drehbare Bindungen | 4 |
|---|
| Schwere Atome | 13 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 162 |
|---|
| Schmelzpunkt | 40°C |
|---|
| Siedepunkt | 145°C 5mm |
|---|
| Dichte | 1.402±0.06 g/cm3(Predicted) |
|---|
| Brechungsindex | 1.5494 |
|---|
| Flammpunkt | 145°C/5mm |
|---|
| Lagerbedingungen | 2-8°C |
|---|
| Aggregatzustand | fused solid |
|---|
| Farbe | White |
|---|
| BRN | 1869569 |
|---|
| InChI | InChI=1S/C10H11BrO2/c1-2-13-10(12)9-5-3-8(7-11)4-6-9/h3-6H,2,7H2,1H3 |
|---|
| InChIKey | TWQLMAJROCNXEA-UHFFFAOYSA-N |
|---|
| SMILES | C(OCC)(=O)C1=CC=C(CBr)C=C1 |
|---|
| CAS Datenbank | 26496-94-6(CAS DataBase Reference) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (76.5%): Harmful if swallowed [Warning Acute toxicity, oral]H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]H317 (70.6%): May cause an allergic skin reaction [Warning Sensitization, Skin]H400 (94.1%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]H410 (94.1%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]P260, P261, P264, P270, P272, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P333+P317, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 17 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|
| Hazard Classes and Categories | Acute Tox. 4 (76.5%)Skin Corr. 1B (100%)Skin Sens. 1 (70.6%)Aquatic Acute 1 (94.1%)Aquatic Chronic 1 (94.1%) |
|---|
| UN-Transportnummer | 1759 |
|---|
| Zollcode | 2916399090 |
|---|
| R-Sätze (R) | 22-34 |
|---|
| Gefahrensymbole | C |
|---|
| Sicherheitshinweise (S) | 26-36/37/39-45 |
|---|
| Gefahrenklasse | 8 |
|---|
| Verpackungsgruppe | II |
|---|
