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DIGOXIGENIN · CAS 1672-46-4 · C23H34O5. UNII NQ1SX9LNAU. Melting Point: 222 °C; LogP: log Kow = 1.10; LogP: 1.58.
| CAS Registry Number | 1672-46-4 |
|---|---|
| PubChem CID | 15478 |
| Molecular formula | C23H34O5 |
| IUPAC name | 3-[(3S,5R,8R,9S,10S,12R,13S,14S,17R)-3,12,14-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one |
| UNII (FDA) | NQ1SX9LNAU |
| Molecular Weight | 390.5 |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 390.24062418 |
| Monoisotopic Mass | 390.24062418 |
| Topological Polar Surface Area | 87 |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Melting Point | 222 °C |
|---|---|
| LogP | log Kow = 1.10 |
| LogP | 1.58 |
| Reported hazard statements | H300 (100%), H310 (100%), H330 (100%) |
|---|
H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]
H310 (100%): Fatal in contact with skin [Danger Acute toxicity, dermal]
Digoxigenin; 1672-46-4; Lanadigenin; Digoxigenine; DTXSID6051778; NQ1SX9LNAU; CHEBI:42098; Card-20(22)-enolide, 3,12,14-trihydroxy-, (3beta,5beta,12beta)-; 3beta,12beta,14-trihydroxy-5beta-card-20(22)-enolide; DTXCID9030333; delta-sup(20:22)-3-beta,12-beta,14,21-Tetrahydroxynorcholenic acid lactone; RefChem:388931; 216-806-2; Lanadigigenin; 3beta,12beta,14-Trihydroxy-5beta,20(22)-cardenolide; Card-20(22)-enolide, 3,12,14-trihydroxy-, (3ss,5ss,12ss)-
CAS 1672-46-4; molecular formula C23H34O5; molecular weight — g/mol.
Digoxigenin, 1672-46-4, Lanadigenin, Digoxigenine, DTXSID6051778, NQ1SX9LNAU.
Hazard statements reported: H300, H310, H330.
Melting Point: 222 °C; LogP: log Kow = 1.10; LogP: 1.58.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.