HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
2-Methylnaphthalin-1,4-diol
menadiol · 2-methylnaphthalene-1,4-diol · vitamink3h2 · reducedvitamink3 · reducedmenadione · dihydrovitamink3 · VITAMIN K4 DIACETATE · VITAMIN K4 USP/EP/BP
Identifikatoren & physikalische Daten
| CAS No. | 481-85-6 |
|---|---|
| Summenformel | C11H10O2 |
| Durchschnittliche Molmasse | 174,2 g/mol |
| Monoisotopische Masse | 174,06807956 g/mol |
| SMILES | Cc1cc(O)c2ccccc2c1O |
| InChIKey | ZJTLZYDQJHKRMQ-UHFFFAOYSA-N |
| PubChem CID | 10209 |
| ChEMBL | CHEMBL1405447 |
| ChEBI | CHEBI:6746 |
| EC No. | 207-573-8 |
| DTXSID | DTXSID5023247 |
| Lokaler Name | 2-Methylnaphthalin-1,4-diol |
Chemische & physikalische Eigenschaften
| XLogP | 2,8 |
|---|---|
| Polarare Oberfläche (TPSA) | 40,5 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 2 |
| Frei drehbare Bindungen | 0 |
| Schwere Atome | 13 |
| Formalladung | 0 |
| Komplexität | 181 |
| SpringerMaterials Properties | Angular frequency |
| Schmelzpunkt | 181℃ |
| Siedepunkt | 265.17°C (rough estimate) |
| Dichte | 1.0844 (rough estimate) |
| Brechungsindex | 1.5250 (estimate) |
| Lagerbedingungen | Sealed in dry,Room Temperature |
| Löslichkeit | DMSO (Slightly), Methanol (Slightly) |
| Aggregatzustand | Solid |
| pKa (Säurekonstante) | 10.62±0.50(Predicted) |
| Farbe | White to Light Purple |
Sicherheit & Vorschriften
| GHS-Einstufung | DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
Anwendungen & Verwendung
Verwenden
Vitamin K3 (V676130) derivative. Menaquinol analog. Induces mutations in Escherichia coli nitrate reductase A.