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Cytisine · CAS 485-35-8 · C11H14N2O. UNII 53S5U404NU. Boiling Point: 218; Boiling Point: BP: 218 °C at 2 mm Hg; Melting Point: 152-153.
| CAS Registry Number | 485-35-8 |
|---|---|
| PubChem CID | 10235 |
| Molecular formula | C11H14N2O |
| IUPAC name | (1R,9S)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one |
| UNII (FDA) | 53S5U404NU |
| Molecular Weight | 190.24 |
|---|---|
| XLogP3 | 0.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 190.110613074 |
| Monoisotopic Mass | 190.110613074 |
| Topological Polar Surface Area | 32.3 |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Boiling Point | 218 |
|---|---|
| Boiling Point | BP: 218 °C at 2 mm Hg |
| Melting Point | 152-153 |
| Melting Point | 152-153 °C (sublimes) |
| Melting Point | MP: 155 °C |
| Solubility | In water, 4.39X10+5 mg/L at 16 °C |
| Dissociation Constants | pK1 = 6.11; pK2 = 13.08 |
| Reported hazard statements | H301 (100%), H315 (90.8%), H319 (90.8%), H335 (89.5%) |
|---|
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
H315 (90.8%): Causes skin irritation [Warning Skin corrosion/irritation]
CYTISINE; 485-35-8; Baptitoxine; Cytisinicline; Sophorine; Baptitoxin; Cytiton; Laburnin; Ulexine; Ulexin; Cytitone; Citizin; Cystisine; Cytizin; (1r,5s)-1,2,3,4,5,6-Hexahydro-8h-1,5-Methanopyrido[1,2-A][1,5]diazocin-8-One; 6039 Sopharma
CAS 485-35-8; molecular formula C11H14N2O; molecular weight — g/mol.
CYTISINE, 485-35-8, Baptitoxine, Cytisinicline, Sophorine, Baptitoxin.
Hazard statements reported: H301, H315, H319, H335.
Boiling Point: 218; Boiling Point: BP: 218 °C at 2 mm Hg; Melting Point: 152-153; Melting Point: 152-153 °C (sublimes).
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.