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Phenethylmethacrylat
PHENYLETHYL METHACRYLATE · Phenethylmethacrylat · PHENETHYL METHACRYLATE · 2-PHENYLETHYL METHACRYLATE · B-PHENYLETHYL METHACRYLATE · beta-phenylethylmethacrylate · beta-Phenylethyl methacrylate · 2-Phenylethyl 2-methylacrylate
Identifikatoren & physikalische Daten
| CAS No. | 3683-12-3 |
|---|---|
| Summenformel | C12H14O2 |
| Durchschnittliche Molmasse | 190,24 g/mol |
| Monoisotopische Masse | 190,09937969 g/mol |
| SMILES | C=C(C)C(=O)OCCc1ccccc1 |
| InChIKey | ILZXXGLGJZQLTR-UHFFFAOYSA-N |
| PubChem CID | 77260 |
| EC No. | 222-969-0 |
| DTXSID | DTXSID7063134 |
| Lokaler Name | Phenethylmethacrylat |
Chemische & physikalische Eigenschaften
| XLogP | 3,3 |
|---|---|
| Polarare Oberfläche (TPSA) | 26,3 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 5 |
| Schwere Atome | 14 |
| Formalladung | 0 |
| Komplexität | 202 |
| Schmelzpunkt | 119~120℃/11mm |
| Siedepunkt | 119-120°C 11mm |
| Dichte | 0,976 g/cm3 |
| Brechungsindex | 1.4970 (estimate) |
| Flammpunkt | 158℃ |
| Aggregatzustand | clear liquid |
| Farbe | Colorless to Light yellow |
| Kosmetik-Inhaltsstoffe Funktionen | PERFUMING |
| InChI | InChI=1S/C12H14O2/c1-10(2)12(13)14-9-8-11-6-4-3-5-7-11/h3-7H,1,8-9H2,2H3 |
| InChIKey | ILZXXGLGJZQLTR-UHFFFAOYSA-N |
| SMILES | C(OCCC1=CC=CC=C1)(=O)C(C)=C |
| LogP (Verteilungskoeffizient) | 3.032 (est) |
| CAS Datenbank | 3683-12-3 |
| EPA chemische Informationen | 2-Phenylethyl methacrylate (3683-12-3) |
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)Aggregated GHS information provided per 92 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: 2-Propenoic acid, 2-methyl-, 2-phenylethyl ester2-Propenoic acid, 2-methyl-, 2-phenylethyl ester: Does not have an individual approval but may be used under an appropriate group standard |
| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
| TSCA-Inventar-Status | TSCA listed |
| Zollcode | 2916.14.2050 |
| R-Sätze (R) | 36/37/38 |
| Toxizität | rabbit,LDLo,skin,5gm/kg (5000mg/kg),Food and Chemical Toxicology. Vol. 30, Pg. 105S, 1992. |
| Sicherheitshinweise (S) | 26-36/37/39 |
Anwendungen & Verwendung
Verwenden
2-Phenylethyl methacrylate finds use in perfume compositions, including soap perfumeswhere it may lend warmth and pleasant “dried-leaf” notes to a Rose or an Oriental type fragrance. It blends well with the Methylionones, Cedarwood products, Jasmin materials, Sandalwood notes, etc. and it can be used in relatively large amounts.