Quetiapine (CAS 111974-69-7) — formula C21H25N3O2S, molecular weight 383.5; category organic chemicals.
Quetiapine (CAS 111974-69-7) is a chemical raw material in the organic chemicals category. Its molecular formula C21H25N3O2S comprises 21 C, 25 H, 3 N, 2 O, 1 S atoms. Its molecular weight is about 383.5. Reported physicochemical data: melting point around 174-176, boiling point around 556.5±60.0, LogP about 2.81. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.
| CAS Number | 111974-69-7 |
|---|---|
| Molecular Formula | C21H25N3O2S |
| Molecular Weight | 383.5 |
| Melting Point | 174-176 |
| Boiling Point | 556.5±60.0 |
| LogP | 2.81 |
| Applications | MEDICATION, Antipsychotic Agents, Use (kg) in Switzerland (2009): >2500, Use (kg, approx.) in Germany (2009): >10000, exact) in Germany (2009): 18887 |
| Category | Organic Chemicals |
Documented applications: MEDICATION, Antipsychotic Agents, Use (kg) in Switzerland (2009): >2500, Use (kg, approx.) in Germany (2009): >10000, exact) in Germany (2009): 18887.
Quetiapine is a carbon-based organic compound with CAS registry number 111974-69-7 and molecular formula C21H25N3O2S (molecular weight 383.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 111974-69-7
Its molecular formula C21H25N3O2S comprises 21 C, 25 H, 3 N, 2 O, 1 S atoms.
Also known as: Quetiapine · 喹硫平
Category: organic chemicals
The CAS registry number of Quetiapine is 111974-69-7.
Molecular formula C21H25N3O2S, molecular weight 383.5.
It is also registered under: Quetiapine, 喹硫平.
Recorded applications: MEDICATION, Antipsychotic Agents, Use (kg) in Switzerland (2009): >2500, Use (kg, approx.) in Germany (2009): >10000, exact) in Germany (2009): 18887.
Category: Organic Chemicals.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for Quetiapine (CAS 111974-69-7), compiled from public chemistry databases.
| CAS Registry Number | 111974-69-7 |
|---|---|
| PubChem CID | 5002 |
| Molecular formula | C21H25N3O2S |
| IUPAC name | 2-[2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]ethanol |
| UNII (FDA) | BGL0JSY5SI |
| Molecular Weight | 383.5 |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 383.16674822 |
| Monoisotopic Mass | 383.16674822 |
| Topological Polar Surface Area | 73.6 |
| Heavy Atom Count | 27 |
| Boiling Point | 556.5±60.0 |
|---|---|
| Melting Point | 174-176 |
| Flash Point | 9.7 °C (49.5 °F) - closed cup |
| LogP | 2.81 |
| LogP | 3.54 |
| Dissociation Constants | 7.06 |
quetiapine; 111974-69-7; quetiapina; Norsic; quetiapinum; 2-[2-(4-benzo[b][1,4]benzothiazepin-6-ylpiperazin-1-yl)ethoxy]ethanol; 2-[2-(4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]ethanol; BGL0JSY5SI; DTXSID9023546; Quetiapine extended release; NSC-758918; 2-(2-(4-Dibenzo(b,f)(1,4)thiazepin-11-yl-1-piperazinyl)ethoxy)ethanol; Ethanol, 2-[2-(4-dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]-; CHEBI:8707; DTXCID903546; Ethanol, 2-(2-(4-dibenzo(b,f)(1,4)thiazepin-11-yl-1-piperazinyl)ethoxy)-
| Reported hazard statements | H302 (100%), H318 (75%), H335 (25%), H400 (25%), H410 (50%), H412 (25%), H225, H301 |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H318 (75%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Quetiapine · CAS 111974-69-7 · C21H25N3O2S. UNII BGL0JSY5SI. Boiling Point: 556.5±60.0; Melting Point: 174-176; Flash Point: 9.7 °C (49.5 °F) - closed cup.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 喹硫平