16 alpha-isothiocyanopregnenolone-3-acetate (CAS 6084-04-4) — formula C24H33NO3S, molecular weight 415.6; category organic chemicals.
| CAS Number | 6084-04-4 |
|---|---|
| Molecular Formula | C24H33NO3S |
| Molecular Weight | 415.6 |
| LogP | 5.5 |
| Category | Organic Chemicals |
16 alpha-isothiocyanopregnenolone-3-acetate is a carbon-based organic compound with CAS registry number 6084-04-4 and molecular formula C24H33NO3S (molecular weight 415.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 6084-04-4
Its molecular formula C24H33NO3S comprises 24 C, 33 H, 1 N, 3 O, 1 S atoms.
Also known as: 16 alpha-isothiocyanopregnenolone-3-acetate · 16 α-异硫氰基孕烯醇酮-3-乙酸酯
Category: organic chemicals
The CAS registry number of 16 alpha-isothiocyanopregnenolone-3-acetate is 6084-04-4.
Molecular formula C24H33NO3S, molecular weight 415.6.
It is also registered under: 16 alpha-isothiocyanopregnenolone-3-acetate, 16 α-异硫氰基孕烯醇酮-3-乙酸酯.
Category: Organic Chemicals.
Independent reference data for 16 alpha-isothiocyanopregnenolone-3-acetate (CAS 6084-04-4), compiled from public chemistry databases.
| CAS 号 | 6084-04-4 |
|---|---|
| PubChem CID | 193418 |
| 分子式 | C24H33NO3S |
| IUPAC 名称 | [(3S,8S,9S,10R,13S,14S,16R,17R)-17-acetyl-16-isothiocyanato-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate |
| Molecular Weight | 415.6 |
|---|---|
| XLogP3 | 5.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 415.21811509 |
| Monoisotopic Mass | 415.21811509 |
| Topological Polar Surface Area | 87.8 |
| Heavy Atom Count | 29 |
6084-04-4; 16-Isothiocyanato-20-oxopregn-5-en-3-yl acetate; DTXSID60976313; 16-Isothiocyanopregnenolone 3-acetate; 16alpha-Isothiocyanopregnenolone-3-acetate; 16alpha-Isothiocyanato-20-oxopregn-5-en-3beta-yl acetate; 3beta-(Acetyloxy)-16alpha-isothiocyanatopregn-5-en-20-one
16 α-异硫氰基孕烯醇酮-3-乙酸酯 · CAS 6084-04-4 · C24H33NO3S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 16 α-异硫氰基孕烯醇酮-3-乙酸酯