methyl 2-acetamido-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate (CAS 92539-89-4) — formula C12H15NO3S, molecular weight 253.32; category organic chemicals.
| CAS Number | 92539-89-4 |
|---|---|
| Molecular Formula | C12H15NO3S |
| Molecular Weight | 253.32 |
| LogP | 2.7 |
| Category | Organic Chemicals |
methyl 2-acetamido-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate is a carbon-based organic compound with CAS registry number 92539-89-4 and molecular formula C12H15NO3S (molecular weight 253.32), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 92539-89-4
Its molecular formula C12H15NO3S comprises 12 C, 15 H, 1 N, 3 O, 1 S atoms.
Also known as: methyl 2-acetamido-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate · 2-乙酰氨基-4,5,6,7-四氢苯并[b]噻吩-3-甲酸甲酯
Category: organic chemicals
The CAS registry number of methyl 2-acetamido-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate is 92539-89-4.
Molecular formula C12H15NO3S, molecular weight 253.32.
It is also registered under: methyl 2-acetamido-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, 2-乙酰氨基-4,5,6,7-四氢苯并[b]噻吩-3-甲酸甲酯.
Category: Organic Chemicals.
Independent reference data for methyl 2-acetamido-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate (CAS 92539-89-4), compiled from public chemistry databases.
| CAS 号 | 92539-89-4 |
|---|---|
| PubChem CID | 646914 |
| 分子式 | C12H15NO3S |
| IUPAC 名称 | methyl 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| UNII（FDA） | HMS2308O22 |
| Molecular Weight | 253.32 |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 253.07726451 |
| Monoisotopic Mass | 253.07726451 |
| Topological Polar Surface Area | 83.6 |
| Heavy Atom Count | 17 |
92539-89-4; methyl 2-(acetylamino)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate; Methyl 2-(acetylamino)-4,5,6,7-tetrahydrobenzo(b)thiophene-3-carboxylate; RefChem:353882; methyl 2-acetamido-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate; methyl 2-(acetylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate; methyl 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate; 2-Acetylamino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid methyl ester; MLS000031308; Oprea1_101743; Oprea1_739000; SCHEMBL5370842; CHEMBL1459483; DTXSID501149583; HMS2308O22; STK058254
2-乙酰氨基-4,5,6,7-四氢苯并[b]噻吩-3-甲酸甲酯 · CAS 92539-89-4 · C12H15NO3S. UNII HMS2308O22.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.