11-Chloro-dibenzo[b,f][1,4]thiazepine (CAS 13745-86-3) — formula C13H8ClNS, molecular weight 245.73; category organic chemicals.
| CAS Number | 13745-86-3 |
|---|---|
| Molecular Formula | C13H8ClNS |
| Molecular Weight | 245.73 |
| LogP | 4.2 |
| Category | Organic Chemicals |
11-Chloro-dibenzo[b,f][1,4]thiazepine is a carbon-based organic compound with CAS registry number 13745-86-3 and molecular formula C13H8ClNS (molecular weight 245.73), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 13745-86-3
Its molecular formula C13H8ClNS comprises 13 C, 8 H, 1 Cl, 1 N, 1 S atoms.
Also known as: 11-Chloro-dibenzo[b,f][1,4]thiazepine · 11-氯二苯并[b,f][1,4]硫氮杂卓
Category: organic chemicals
The CAS registry number of 11-Chloro-dibenzo[b,f][1,4]thiazepine is 13745-86-3.
Molecular formula C13H8ClNS, molecular weight 245.73.
It is also registered under: 11-Chloro-dibenzo[b,f][1,4]thiazepine, 11-氯二苯并[b,f][1,4]硫氮杂卓.
Category: Organic Chemicals.
Independent reference data for 11-Chloro-dibenzo[b,f][1,4]thiazepine (CAS 13745-86-3), compiled from public chemistry databases.
| CAS Registry Number | 13745-86-3 |
|---|---|
| PubChem CID | 10586481 |
| Molecular formula | C13H8ClNS |
| IUPAC name | 6-chlorobenzo[b][1,4]benzothiazepine |
| UNII (FDA) | GKL3VNL5B7 |
| Molecular Weight | 245.73 |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 245.0065981 |
| Monoisotopic Mass | 245.0065981 |
| Topological Polar Surface Area | 37.7 |
| Heavy Atom Count | 16 |
13745-86-3; 11-Chlorodibenzo[b,f][1,4]thiazepine; Dibenzo[b,f][1,4]thiazepine, 11-chloro-; GKL3VNL5B7; 11-Chlorodibenzo(b,f)(1,4)thiazepine; Dibenzo(b,f)(1,4)thiazepine, 11-chloro-; RefChem:1057340; 604-020-6; 11-chloro-dibenzo[b,f][1,4]thiazepine; 6-chlorobenzo[b][1,4]benzothiazepine; Quetiapine DBTC Impurity; MFCD07782128; 11-Chloro-dibenzo[b,f][1,4] thiazepine; Quetiapine Impurity 32; SCHEMBL8470; MLS004820230
| Reported hazard statements | H302 (100%), H315 (100%), H319 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
11-Chloro-dibenzo[b,f][1,4]thiazepine · CAS 13745-86-3 · C13H8ClNS. UNII GKL3VNL5B7.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 11-氯二苯并[b,f][1,4]硫氮杂卓