estradiol 3-acetate (CAS 4245-41-4) — formula C20H26O3, molecular weight 314.4; category organic chemicals.
| CAS Number | 4245-41-4 |
|---|---|
| Molecular Formula | C20H26O3 |
| Molecular Weight | 314.4 |
| LogP | 2.8 |
| Category | Organic Chemicals |
estradiol 3-acetate is a carbon-based organic compound with CAS registry number 4245-41-4 and molecular formula C20H26O3 (molecular weight 314.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4245-41-4
Its molecular formula C20H26O3 comprises 20 C, 26 H, 3 O atoms.
Also known as: estradiol 3-acetate · 3-乙酸雌二醇
Category: organic chemicals
The CAS registry number of estradiol 3-acetate is 4245-41-4.
Molecular formula C20H26O3, molecular weight 314.4.
It is also registered under: estradiol 3-acetate, 3-乙酸雌二醇.
Category: Organic Chemicals.
Independent reference data for estradiol 3-acetate (CAS 4245-41-4), compiled from public chemistry databases.
| CAS Registry Number | 4245-41-4 |
|---|---|
| PubChem CID | 9818306 |
| Molecular formula | C20H26O3 |
| IUPAC name | [(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] acetate |
| UNII (FDA) | 5R97F5H93P |
| Molecular Weight | 314.4 |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 314.18819469 |
| Monoisotopic Mass | 314.18819469 |
| Topological Polar Surface Area | 46.5 |
| Heavy Atom Count | 23 |
| Collision Cross Section | 185.16 Ų [M-H]- |
|---|
Estradiol acetate; 4245-41-4; Femring; Femtrace; Estradiol 3-acetate; Estradiol-3-acetate; Menoring; 3-O-Acetylestradiol; 17beta-Estradiol 3-acetate; Estradiol, 3-acetate; DTXSID7045867; beta-Estradiol 3-acetate; UNII-5R97F5H93P; E 3A; 5R97F5H93P; DTXCID5025867
| Reported hazard statements | H351 (96.2%), H360 (100%), H362 (96.2%) |
|---|
H351 (96.2%): Suspected of causing cancer [Warning Carcinogenicity]
H360 (100%): May damage fertility or the unborn child [Danger Reproductive toxicity]
estradiol 3-acetate · CAS 4245-41-4 · C20H26O3. UNII 5R97F5H93P. Collision Cross Section: 185.16 Ų [M-H]-.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-乙酸雌二醇