Tacalcitol (CAS 57333-96-7) — formula C27H44O3, molecular weight 416.6; category organic chemicals.
| CAS Number | 57333-96-7 |
|---|---|
| Molecular Formula | C27H44O3 |
| Molecular Weight | 416.6 |
| LogP | 5.3 |
| Category | Organic Chemicals |
Tacalcitol is a carbon-based organic compound with CAS registry number 57333-96-7 and molecular formula C27H44O3 (molecular weight 416.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 57333-96-7
Its molecular formula C27H44O3 comprises 27 C, 44 H, 3 O atoms.
Also known as: Tacalcitol · 塔骨化醇
Category: organic chemicals
The CAS registry number of Tacalcitol is 57333-96-7.
Molecular formula C27H44O3, molecular weight 416.6.
It is also registered under: Tacalcitol, 塔骨化醇.
Category: Organic Chemicals.
Independent reference data for Tacalcitol (CAS 57333-96-7), compiled from public chemistry databases.
| CAS Registry Number | 57333-96-7 |
|---|---|
| PubChem CID | 5283734 |
| Molecular formula | C27H44O3 |
| IUPAC name | trans-(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,5R)-5-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol |
| UNII (FDA) | C2W72OJ5ZU |
| Molecular Weight | 416.6 |
|---|---|
| XLogP3 | 5.3 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 6 |
| Exact Mass | 416.32904526 |
| Monoisotopic Mass | 416.32904526 |
| Topological Polar Surface Area | 60.7 |
| Heavy Atom Count | 30 |
tacalcitol; 57333-96-7; Bonalfa; Tacalcitolum; TV-02; PRI 2191; 1-alpha,24(R)-Dihydroxyvitamin D3; TV 02; C2W72OJ5ZU; CHEBI:32176; DTXSID90905111; (1S,3R,5Z,7E,24R)-9,10-secocholesta-5,7,10-triene-1,3,24-triol; (+)-(5Z,7E,24R)-9,10-Secocholesta-5,7,10(19)-triene-1alpha,3beta,24-triol; RefChem:890199; D05AX04; DTXCID601334214
| Reported hazard statements | H300 (100%) |
|---|
H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Tacalcitol · CAS 57333-96-7 · C27H44O3. UNII C2W72OJ5ZU.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 塔骨化醇