ethyl 3-cyano-2-mercapto-6-methylisonicotinate (CAS 56891-69-1) — formula C10H10N2O2S, molecular weight 222.27; category organic chemicals.
| CAS Number | 56891-69-1 |
|---|---|
| Molecular Formula | C10H10N2O2S |
| Molecular Weight | 222.27 |
| LogP | 1 |
| Category | Organic Chemicals |
ethyl 3-cyano-2-mercapto-6-methylisonicotinate is a carbon-based organic compound with CAS registry number 56891-69-1 and molecular formula C10H10N2O2S (molecular weight 222.27), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 56891-69-1
Its molecular formula C10H10N2O2S comprises 10 C, 10 H, 2 N, 2 O, 1 S atoms.
Also known as: ethyl 3-cyano-2-mercapto-6-methylisonicotinate · 3-氰基-2-巯基-6-甲基异烟酸乙酯
Category: organic chemicals
The CAS registry number of ethyl 3-cyano-2-mercapto-6-methylisonicotinate is 56891-69-1.
Molecular formula C10H10N2O2S, molecular weight 222.27.
It is also registered under: ethyl 3-cyano-2-mercapto-6-methylisonicotinate, 3-氰基-2-巯基-6-甲基异烟酸乙酯.
Category: Organic Chemicals.
Independent reference data for ethyl 3-cyano-2-mercapto-6-methylisonicotinate (CAS 56891-69-1), compiled from public chemistry databases.
| CAS Registry Number | 56891-69-1 |
|---|---|
| PubChem CID | 723622 |
| Molecular formula | C10H10N2O2S |
| IUPAC name | ethyl 3-cyano-6-methyl-2-sulfanylidene-1H-pyridine-4-carboxylate |
| UNII (FDA) | HMS1541F06 |
| Molecular Weight | 222.27 |
|---|---|
| XLogP3 | 1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 222.04629874 |
| Monoisotopic Mass | 222.04629874 |
| Topological Polar Surface Area | 94.2 |
| Heavy Atom Count | 15 |
3-Cyano-2-mercapto-6-methyl-isonicotinic acid ethyl ester; RefChem:500583; 678-750-9; 56891-69-1; Ethyl 3-cyano-2-mercapto-6-methylisonicotinate; ethyl 3-cyano-6-methyl-2-sulfanylpyridine-4-carboxylate; Ethyl 3-Cyano-2-Mercapto-6-Methylpyridine-4-Carboxylate; MFCD00052275; MLS000043775; ethyl 3-cyano-6-methyl-2-sulfanylidene-1H-pyridine-4-carboxylate; 3-Cyano-2-mercapto-6-methyl-isonicotinic acidethyl ester; SMR000020985; ethyl 3-cyano-6-methyl-2-thioxo-1,2-dihydropyridine-4-carboxylate; Ethyl 3-cyano-6-methyl-2-sulphanylisonicotinate; TimTec1_002580; cid_723622
| Reported hazard statements | H302, H312, H332 (20%), H315 (100%), H319 (100%), H335 (100%) |
|---|
H302+H312+H332 (20%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
ethyl 3-cyano-2-mercapto-6-methylisonicotinate · CAS 56891-69-1 · C10H10N2O2S. UNII HMS1541F06.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-氰基-2-巯基-6-甲基异烟酸乙酯