HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
4-Chloroguaiacol
p-Chloroguaiacol · 4-CHLOROGUAIACOL · 4-chloro-2-methoxy-pheno · 2-Methoxy-4-chlorophenol · 4-Chloro-2-methoxyphenol · PHENOL,4-CHLORO-2-METHOXY · 4-Chloro-2-methoxyphenol >4-Chloro-2-methoxyphenol,99% · 4-CHLORO-2-METHOXYPHENOL, TECH.
Identifikatoren & physikalische Daten
| CAS No. | 16766-30-6 |
|---|---|
| Summenformel | C7H7ClO2 |
| Durchschnittliche Molmasse | 158,58 g/mol |
| Monoisotopische Masse | 158,01345714 g/mol |
| SMILES | COc1cc(Cl)ccc1O |
| InChIKey | FVZQMMMRFNURSH-UHFFFAOYSA-N |
| PubChem CID | 28050 |
| ChEMBL | CHEMBL3416134 |
| EC No. | 627-256-1 |
| DTXSID | DTXSID0074974 |
Chemische & physikalische Eigenschaften
| XLogP | 1,5 |
|---|---|
| Polarare Oberfläche (TPSA) | 29,5 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 1 |
| Schwere Atome | 10 |
| Formalladung | 0 |
| Komplexität | 108 |
| Schmelzpunkt | 16-17 °C (lit.) |
| Siedepunkt | 241 °C (lit.) |
| Dichte | 1.304 g/mL at 25 °C (lit.) |
| Brechungsindex | n20/D 1.559(lit.) |
| Flammpunkt | >230 °F |
| Lagerbedingungen | Inert atmosphere,Room Temperature |
| Löslichkeit | DMSO (Sparingly), Methanol (Slightly)It is slightly soluble in water. |
| pKa (Säurekonstante) | 9.52±0.18(Predicted) |
| Aggregatzustand | Liquid |
| Wichte | 1.30 |
| Farbe | Clear pale yellow to light brown |
| BRN | 1940516 |
| InChI | 1S/C7H7ClO2/c1-10-7-4-5(8)2-3-6(7)9/h2-4,9H,1H3 |
| InChIKey | FVZQMMMRFNURSH-UHFFFAOYSA-N |
| SMILES | COc1cc(Cl)ccc1O |
| CAS Datenbank | 16766-30-6(CAS DataBase Reference) |
| EPA chemische Informationen | Phenol, 4-chloro-2-methoxy- (16766-30-6) |
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (11.1%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (11.1%) |
| Wassergefährdungsklasse (WGK) | 3 |
| Zollcode | 29095000 |
| R-Sätze (R) | 36/37/38 |
| Gefahrensymbole | Xi |
| hazard_note | Irritant |
| Sicherheitshinweise (S) | 26-37/39 |
| Lagerklasse | 10 - Combustible liquids |
| Gefahrenklasse | Eye Irrit. 2Skin Irrit. 2STOT SE 3 |
Anwendungen & Verwendung
Verwenden
4-Chloro-2-methoxyphenol, is used as an intermediate in pharmaceutical research, pharmaceutical chemicals and reagents. It is also used as an application intermediate. it can be used to produce 4-Chloro-2-methoxy-6-nitrophenol.