HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
Methyl 1-hydroxy-1-cyclopropane carboxylate
Methyl 1-Hydroxycyclopropane-1-carboxylate · Methyl 1-Hydroxycyclopropanecarboxylate · METHYL 1-HYDROXY-1-CYCLOPROPANE · Methyl 1-hydroxy-cyclopropan-carboxylate · METHYL 1-HYDROXY-1-CYCLOPROPANE CARBOXYL · Methyl 1-hydroxy-1-cyclopropane carboxylate, 90 · 1-Hydroxycyclopropanecarboxylic Acid Methyl Ester · Methyl 1-hydroxy-1-cyclopropane carboxylate, 90% 5GR
Identifikatoren & physikalische Daten
| CAS No. | 33689-29-1 |
|---|---|
| Summenformel | C5H8O3 |
| Durchschnittliche Molmasse | 116,11 g/mol |
| Monoisotopische Masse | 116,04734412 g/mol |
| SMILES | COC(=O)C1(O)CC1 |
| InChIKey | KPJWVJURYXOHOO-UHFFFAOYSA-N |
| PubChem CID | 2733178 |
| EC No. | 827-536-5 |
| DTXSID | DTXSID00369780 |
Chemische & physikalische Eigenschaften
| XLogP | -0,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 46,5 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 8 |
| Formalladung | 0 |
| Komplexität | 115 |
| Siedepunkt | 70°C/13mmHg |
| Dichte | 1.346±0.06 g/cm3(Predicted) |
| Flammpunkt | 17℃ |
| Lagerbedingungen | Sealed in dry,2-8°C |
| Löslichkeit | Dichloromethane, Methanol |
| pKa (Säurekonstante) | 13.14±0.20(Predicted) |
| Aggregatzustand | Liquid |
| Farbe | Clear yellow |
| InChI | InChI=1S/C5H8O3/c1-8-4(6)5(7)2-3-5/h7H,2-3H2,1H3 |
| InChIKey | KPJWVJURYXOHOO-UHFFFAOYSA-N |
| SMILES | C1(O)(C(OC)=O)CC1 |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Flam. Liq. 2 (100%) |
| UN-Transportnummer | 3277 |
| Zollcode | 29162090 |
| R-Sätze (R) | 11 |
| Sicherheitshinweise (S) | 16 |
Anwendungen & Verwendung
Verwenden
1-Hydroxycyclopropanecarboxylic Acid Methyl Ester (cas# 33689-29-1) is a compound useful in organic synthesis.