ethyl 2-mercapto-1H-imidazole-4-carboxylate (CAS 64038-64-8) — formula C6H8N2O2S, molecular weight 172.21; category organic chemicals.
| CAS Number | 64038-64-8 |
|---|---|
| Molecular Formula | C6H8N2O2S |
| Molecular Weight | 172.21 |
| LogP | 0.2 |
| Category | Organic Chemicals |
ethyl 2-mercapto-1H-imidazole-4-carboxylate is a carbon-based organic compound with CAS registry number 64038-64-8 and molecular formula C6H8N2O2S (molecular weight 172.21), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 64038-64-8
Its molecular formula C6H8N2O2S comprises 6 C, 8 H, 2 N, 2 O, 1 S atoms.
Also known as: ethyl 2-mercapto-1H-imidazole-4-carboxylate · 2-巯基-1H-咪唑-4-甲酸乙酯
Category: organic chemicals
The CAS registry number of ethyl 2-mercapto-1H-imidazole-4-carboxylate is 64038-64-8.
Molecular formula C6H8N2O2S, molecular weight 172.21.
It is also registered under: ethyl 2-mercapto-1H-imidazole-4-carboxylate, 2-巯基-1H-咪唑-4-甲酸乙酯.
Category: Organic Chemicals.
Independent reference data for ethyl 2-mercapto-1H-imidazole-4-carboxylate (CAS 64038-64-8), compiled from public chemistry databases.
| CAS Registry Number | 64038-64-8 |
|---|---|
| PubChem CID | 2736338 |
| Molecular formula | C6H8N2O2S |
| IUPAC name | ethyl 2-sulfanylidene-1,3-dihydroimidazole-4-carboxylate |
| UNII (FDA) | ST51041508 |
| Molecular Weight | 172.21 |
|---|---|
| XLogP3 | 0.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 172.03064868 |
| Monoisotopic Mass | 172.03064868 |
| Topological Polar Surface Area | 82.5 |
| Heavy Atom Count | 11 |
Ethyl 2-sulfanyl-1H-imidazole-4-carboxylate; RefChem:594520; 670-660-8; 64038-64-8; ethyl 2-mercapto-1h-imidazole-4-carboxylate; 4-Ethoxycarbonylimidazole-2-thiol; USAF EL-63; MFCD00068042; Imidazole-2-thiol, 5-ethoxycarbonyl-; 2-Mercapto-5-carbethoxyimidazole; ethyl 2-sulfanylidene-1,3-dihydroimidazole-4-carboxylate; Imidazole, 2-mercapto-5-carbethoxy-; ethyl 2-sulfanylidene-2,3-dihydro-1H-imidazole-4-carboxylate; 2-mercapto-1h-imidazole-4-carboxylic acid ethyl ester; ethyl2-mercapto-1h-imidazole-4-carboxylate; 1H-Imidazole-4-carboxylic acid, 2,3-dihydro-2-thioxo-, ethyl ester
| Reported hazard statements | H302 (50%), H315 (100%), H319 (100%), H335 (100%) |
|---|
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
ethyl 2-mercapto-1H-imidazole-4-carboxylate · CAS 64038-64-8 · C6H8N2O2S. UNII ST51041508.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-巯基-1H-咪唑-4-甲酸乙酯