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(R)-1-(2-Methoxyphenyl)ethanamine
2-Methoxy-a-Methyl- · (R)-2-Methoxy-α-methylbenzylamine · (R)-1-(2-METHOXYPHENYL)ETHYLAMINE · (R)-1-(2-METHOXYPHENYL)ETHANAMINE · (R)-o-Methoxy-alpha-phenethylamine · (R)-1-(2-methoxyphenyl)ethan-1-amine · (R)-(+)-2-METHOXY A-METHYLBENZYLAMINE · (R)-2-METHOXY-ALPHA-METHYLBENZYLAMINE

Identifikatoren & physikalische Daten
| CAS No. | 68285-23-4 |
|---|---|
| Summenformel | C9H13NO |
| Durchschnittliche Molmasse | 151,21 g/mol |
| Monoisotopische Masse | 151,09971404 g/mol |
| SMILES | COc1ccccc1[C@@H](C)N |
| InChIKey | VENQOHAPVLVQKV-SSDOTTSWSA-N |
| PubChem CID | 853083 |
| EC No. | 662-799-8 |
| DTXSID | DTXSID90357393 |
Chemische & physikalische Eigenschaften
| XLogP | 1,2 |
|---|---|
| Polarare Oberfläche (TPSA) | 35,3 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 2 |
| Schwere Atome | 11 |
| Formalladung | 0 |
| Komplexität | 116 |
| Siedepunkt | 118°C/17mm |
| Dichte | 1.003±0.06 g/cm3(Predicted) |
| Flammpunkt | 118°C/17mm |
| Lagerbedingungen | under inert gas (nitrogen or Argon) at 2-8°C |
| Löslichkeit | Soluble in dimethyl sulfoxide. |
| Aggregatzustand | liquid |
| pKa (Säurekonstante) | 9.13±0.10(Predicted) |
| InChI | 1S/C9H13NO/c1-7(10)8-5-3-4-6-9(8)11-2/h3-7H,10H2,1-2H3/t7-/m1/s1 |
| InChIKey | VENQOHAPVLVQKV-SSDOTTSWSA-N |
| SMILES | COc1ccccc1[C@@H](C)N |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P261, P264, P271, P273, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 42 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Skin Corr. 1B (100%) |
| Wassergefährdungsklasse (WGK) | WGK 3 |
| UN-Transportnummer | 2735 |
| R-Sätze (R) | 21/22-34-52/53-20 |
| Gefahrensymbole | C |
| Sicherheitshinweise (S) | 26-36/37/39-61-45 |
| Gefahrenklasse | 8Acute Tox. 3 InhalationAquatic Chronic 3Skin Corr. 1B |
| Verpackungsgruppe | III |
| Lagerklasse | 6.1D - Non-combustible acute toxic Cat.3toxic hazardous materials or hazardous materials causing chronic effects |
Anwendungen & Verwendung
Verwenden
The derivatives of the compound, are used as a potential ligand in developing radioiodinated antagonists for in vivo imaging of 5-HT1A receptors.