HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Methylundec-10-enoat
METHYL UNDECENOATE · NSC 1273 · methylundec-10 · Maskod MNS 01-10 · Methyl 10-undecen · Eleven Methyl-ene · Methyl undecenate · METHYL UNDECYLENATE
Identifikatoren & physikalische Daten
| CAS No. | 111-81-9 |
|---|---|
| Summenformel | C12H22O2 |
| Durchschnittliche Molmasse | 198,3 g/mol |
| Monoisotopische Masse | 198,16197994 g/mol |
| SMILES | C=CCCCCCCCCC(=O)OC |
| InChIKey | KISVAASFGZJBCY-UHFFFAOYSA-N |
| PubChem CID | 8138 |
| ChEMBL | CHEMBL1591973 |
| ChEBI | CHEBI:87493 |
| EC No. | 203-910-8 |
| DTXSID | DTXSID5046566 |
| Lokaler Name | Methylundec-10-enoat |
Chemische & physikalische Eigenschaften
| XLogP | 4,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 26,3 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 10 |
| Schwere Atome | 14 |
| Formalladung | 0 |
| Komplexität | 152 |
| Lipide | Fatty Acyls [FA] -> Fatty esters [FA07] -> Short fatty esters [FA0710] |
| SpringerMaterials Properties | Boiling point |
| Duftstoffe | Fragrance Ingredient (Methyl undec-10-enoate) -> IFRA transparency List |
| Lebensmittelzusatzstoffe | FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food |
| Dichte | 0.885-0.891 (20 °C)0.882 g/mL at 25 °C (lit.) |
| Löslichkeit | slightlySlightly soluble in waterSoluble (in ethanol)H2O: insoluble794μg/L at 20℃ |
| Siedepunkt | 245.00 to 248.00 °C. @ 760.00 mm Hg243-247 °C245 °C (lit.) |
| Schmelzpunkt | 27.5 °C26-27℃ |
| Brechungsindex | 1.436-1.442n20/D 1.437(lit.) |
| Physical Description | SolidColourless liquidOily aroma |
| Dampfdruck | 2.1hPa at 25℃ |
| FEMA | 4253 | METHYL 10-UNDECENOATE |
| Flammpunkt | >230 °F |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Aggregatzustand | clear liquid |
| Wichte | 0.882 |
| Farbe | Colorless to Light yellow |
| Geruch | at 100.00 %. fatty waxy citrus earthy fungal rose floral |
| Geruchsart | fatty |
| Biologische Quelle | synthetic |
| JECFA Number | 1639 |
| Hauptanwendungen | flavors and fragrances |
| Kosmetik-Inhaltsstoffe Funktionen | PERFUMINGDEODORANT |
| InChI | 1S/C12H22O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3H,1,4-11H2,2H3 |
| InChIKey | KISVAASFGZJBCY-UHFFFAOYSA-N |
| SMILES | COC(=O)CCCCCCCCC=C |
| LogP (Verteilungskoeffizient) | 5.3 at 20℃ |
| CAS Datenbank | 111-81-9(CAS DataBase Reference) |
| EPA chemische Informationen | 10-Undecenoic acid, methyl ester (111-81-9) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P270, P271, P273, P301+P317, P304+P340, P317, P330, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 1496 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Regulatorische Informationen | Chemical: 10-Undecenoic acid, methyl esterStatus: Active Update: 11-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/10072Methyl-10-undecenoate: Does not have an individual approval but may be used under an appropriate group standard |
| Weitere Sicherheitsinformationen | IMAP assessments - 10-Undecenoic acid, methyl ester: Human health tier I assessment |
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
| Wassergefährdungsklasse (WGK) | 3 |
| TSCA-Inventar-Status | TSCA listed |
| UN-Transportnummer | UN 3082 9 / PGIII |
| Zollcode | 29161900 |
| R-Sätze (R) | 36/37/38-20/22 |
| Gefahrensymbole | Xn,N |
| Sicherheitshinweise (S) | 26-36/37/39-61-60-24/25 |
| Lagerklasse | 10 - Combustible liquids |
| Gefahrenklasse | Acute Tox. 4 InhalationAcute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1 |
Anwendungen & Verwendung
Verwenden
Methyl 10-undecenoate, unsaturated fatty acid ester, is used to modify commercial silicone monomer, 1,3,5,7-tetramethylcyclotetrasiloxane for the preparation of silicone hollow nano/microstructures in water.