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Methallenestril
Ercostrol · Vallestril · Novestrine · methallenestril · methallenestril USP/EP/BP · 3-(6-methoxy-2-naphthyl)-2,2-dimethyl-valeric acid · 3-(6-methoxynaphthalen-2-yl)-2,2-dimethylpentanoic acid · 3-(6-methoxynaphthalen-2-yl)-2,2-dimethyl-pentanoic acid

Identifikatoren & physikalische Daten
| CAS No. | 15372-35-7 |
|---|---|
| Summenformel | C18H22O3 |
| Durchschnittliche Molmasse | 286,4 g/mol |
| Monoisotopische Masse | 286,15689456 g/mol |
| SMILES | CCC(c1ccc2cc(OC)ccc2c1)C(C)(C)C(=O)O |
| InChIKey | KHLJKRBMZVNZOC-UHFFFAOYSA-N |
| PubChem CID | 10599 |
| ChEMBL | CHEMBL1697842 |
| ChEBI | CHEBI:6808 |
| EC No. | 208-232-6 |
| DTXSID | DTXSID7023275 |
| Lokaler Name | Methallenestril |
Chemische & physikalische Eigenschaften
| XLogP | 4,7 |
|---|---|
| Polarare Oberfläche (TPSA) | 46,5 |
| H-Brücken-Donoren | 1 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 5 |
| Schwere Atome | 21 |
| Formalladung | 0 |
| Komplexität | 363 |
| Color/Form | CRYSTALS FROM DIL METHANOL |
| Löslichkeit | SOL IN ETHER & VEGETABLE OILSINSOL IN WATERFREELY SOL IN CHLOROFORM |
| Schmelzpunkt | 139-140 °C139-140° |
| Siedepunkt | 437.0±20.0 °C(Predicted) |
| Dichte | 1.108±0.06 g/cm3(Predicted) |
| pKa (Säurekonstante) | 4.88±0.50(Predicted) |
Sicherheit & Vorschriften
| Human Toxicity Excerpts | BREAST ENLARGEMENT & NODULARITY OCCURRED IN BOTH MALE & FEMALE CHILDREN AFTER CONSUMPTION OF VITAMIN CAPSULES CONTAMINATED WITH ESTROGENS. /ESTROGEN/MALAISE, IRRITABILITY, & DEPRESSION...OCCUR WITH SMALL DOSES &...WITH LARGE DOSES. EFFECT ON LIBIDO IS ERRATIC, BEING INCR IN SOME & DECR IN OTHERS. ... CHANGES IN CONCN OF SOME OF CLOTTING FACTORS IN BLOOD...INCR INCIDENCE OF THROMBOPHLEBITIS & THROMBOEMBOLISM IN...SUPERFICIAL & DEEP VEINS. /ESTROGENS/PULMONARY EMBOLISM, CEREBRAL EMBOLISM WITH STROKE & MESENTERIC VASCULAR OCCULSION OCCUR. CORONARY THROMBOSIS...INCR... ALTER HEPATIC FUNCTION, WHICH... ALTER...TESTS OF LIVER FUNCTION AS WELL AS VARIOUS SYNTHETIC & BIOTRANSFORMATION PROCESSES. ...DECR IN GLUCOSE TOLERANCE, & DIABETES MELLITUS MAY BE EXACERBATED. /ESTROGENS/SERUM TRIGLYCERIDES RISE, &...HYPERLIPIDEMIA MAY OCCUR... COMPOSITION IS ALTERED...INCR OF GALL STONES... PORPHYRIA MAY BE PROVOKED. CHANGES IN CONCN OF BLOOD PROTEINS MAY OCCURTHYROXINE- & GLUCOCORTICOID-BINDING PROTEINS ARE INCR, WHICH MAY ALTER ENDOCRINE RELATIONSHIPS. /ESTROGENS/For more Human Toxicity Excerpts (Complete) data for METHALLENESTRIL (10 total), please visit the HSDB record page. |
|---|---|
| Gefahrstoffdaten | 517-18-0(Hazardous Substances Data) |
Anwendungen & Verwendung
Verwenden
Medicine (estrogen).