PYRITHIOXIN (CAS 1098-97-1) — formula C16H20N2O4S2, molecular weight 368.5; category organic chemicals.
| CAS Number | 1098-97-1 |
|---|---|
| Molecular Formula | C16H20N2O4S2 |
| Molecular Weight | 368.5 |
| LogP | 3.08 |
| Applications | Uses: Use (kg, approx.) in Germany (2009): >50, Consumption (g per capita, approx.) in Germany (2009): 0.000611, Calculated removal (%): 9 |
| Category | Organic Chemicals |
Documented applications: Uses: Use (kg, approx.) in Germany (2009): >50, Consumption (g per capita, approx.) in Germany (2009): 0.000611, Calculated removal (%): 9.
PYRITHIOXIN is a carbon-based organic compound with CAS registry number 1098-97-1 and molecular formula C16H20N2O4S2 (molecular weight 368.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1098-97-1
Its molecular formula C16H20N2O4S2 comprises 16 C, 20 H, 2 N, 4 O, 2 S atoms.
Also known as: PYRITHIOXIN · 吡硫醇
Category: organic chemicals
The CAS registry number of PYRITHIOXIN is 1098-97-1.
Molecular formula C16H20N2O4S2, molecular weight 368.5.
It is also registered under: PYRITHIOXIN, 吡硫醇.
Recorded applications: Uses: Use (kg, approx.) in Germany (2009): >50, Consumption (g per capita, approx.) in Germany (2009): 0.000611, Calculated removal (%): 9.
Category: Organic Chemicals.
Independent reference data for PYRITHIOXIN (CAS 1098-97-1), compiled from public chemistry databases.
| CAS 号 | 1098-97-1 |
|---|---|
| PubChem CID | 14190 |
| 分子式 | C16H20N2O4S2 |
| IUPAC 名称 | 5-[[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methyldisulfanyl]methyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol |
| UNII（FDA） | AK5Q5FZH2R |
| Molecular Weight | 368.5 |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 368.08644947 |
| Monoisotopic Mass | 368.08644947 |
| Topological Polar Surface Area | 157 |
| Heavy Atom Count | 24 |
| LogP | 3.08 |
|---|
Pyrithioxin; PYRITINOL; 1098-97-1; Pyrithioxine; Piritinol; Dipyridoxolyldisulfide; Pyritinolum; Piritinolo; AK5Q5FZH2R; NSC-759229; DTXSID3048362; Pyridoxinedisulfide; RefChem:202792; DTXCID9028336; N06BX02; 4-Pyridinemethanol, 3,3'-(dithiobis(methylene))bis(5-hydroxy-6-methyl-)
| 已通报的危害声明 | H315 (100%), H318 (100%), H335 (100%) |
|---|
吡硫醇 · CAS 1098-97-1 · C16H20N2O4S2. UNII AK5Q5FZH2R. LogP: 3.08.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 吡硫醇