2-Mercapto-6-nitrobenzothiazole (CAS 4845-58-3) — formula C7H4N2O2S2, molecular weight 212.3; category organic chemicals.
2-Mercapto-6-nitrobenzothiazole (CAS 4845-58-3) is a chemical raw material in the organic chemicals category. Its molecular formula C7H4N2O2S2 comprises 7 C, 4 H, 2 N, 2 O, 2 S atoms. Its molecular weight is about 212.3. Reported physicochemical data: LogP about 2.2. 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 | 4845-58-3 |
|---|---|
| Molecular Formula | C7H4N2O2S2 |
| Molecular Weight | 212.3 |
| LogP | 2.2 |
| Category | Organic Chemicals |
2-Mercapto-6-nitrobenzothiazole is a carbon-based organic compound with CAS registry number 4845-58-3 and molecular formula C7H4N2O2S2 (molecular weight 212.3), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4845-58-3
Its molecular formula C7H4N2O2S2 comprises 7 C, 4 H, 2 N, 2 O, 2 S atoms.
Also known as: 2-Mercapto-6-nitrobenzothiazole · 2-巯基-6-硝基苯并噻唑
Category: organic chemicals
The CAS registry number of 2-Mercapto-6-nitrobenzothiazole is 4845-58-3.
Molecular formula C7H4N2O2S2, molecular weight 212.3.
It is also registered under: 2-Mercapto-6-nitrobenzothiazole, 2-巯基-6-硝基苯并噻唑.
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 2-Mercapto-6-nitrobenzothiazole (CAS 4845-58-3), compiled from public chemistry databases.
| CAS Registry Number | 4845-58-3 |
|---|---|
| PubChem CID | 947375 |
| Molecular formula | C7H4N2O2S2 |
| IUPAC name | 6-nitro-3H-1,3-benzothiazole-2-thione |
| UNII (FDA) | C7H4N2O2S2 |
| Molecular Weight | 212.3 |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 211.97141972 |
| Monoisotopic Mass | 211.97141972 |
| Topological Polar Surface Area | 115 |
| Heavy Atom Count | 13 |
2-Mercapto-6-nitrobenzothiazole; 4845-58-3; 6-Nitro-2-mercaptobenzothiazole; 2(3H)-Benzothiazolethione, 6-nitro-; 6-Nitrobenzothiazole-2-thiol; USAF EK-3991; 2-Benzothiazolinethione, 6-nitro-; NSC 2630; 2-BENZOTHIAZOLETHIOL, 6-NITRO-; DTXSID3063621; 6-nitro-2(3h)-benzothiazolethione; RefChem:439845; DTXCID0040624; 2-Benzothiazolinethione, 6-nitro-(8CI); 678-269-4; 6-Nitrobenzo[d]thiazole-2(3H)-thione
| Reported hazard statements | H302 (83.3%), H312 (16.7%), H315 (100%), H319 (100%), H332 (16.7%), H335 (83.3%) |
|---|
H302 (83.3%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (16.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]
2-Mercapto-6-nitrobenzothiazole · CAS 4845-58-3 · C7H4N2O2S2. UNII C7H4N2O2S2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-巯基-6-硝基苯并噻唑