7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid(SALTDATA: FREE) (CAS 96334-46-2) — formula C9H8O3S, molecular weight 196.22; category organic chemicals.
| CAS Number | 96334-46-2 |
|---|---|
| Molecular Formula | C9H8O3S |
| Molecular Weight | 196.22 |
| LogP | 1.6 |
| Category | Organic Chemicals |
7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid(SALTDATA: FREE) is a carbon-based organic compound with CAS registry number 96334-46-2 and molecular formula C9H8O3S (molecular weight 196.22), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96334-46-2
Its molecular formula C9H8O3S comprises 9 C, 8 H, 3 O, 1 S atoms.
Also known as: 7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid(SALTDATA: FREE) · 7-氧代-4,5,6,7-四氢苯并[B]噻吩-3-羧酸
Category: organic chemicals
The CAS registry number of 7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid(SALTDATA: FREE) is 96334-46-2.
Molecular formula C9H8O3S, molecular weight 196.22.
It is also registered under: 7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid(SALTDATA: FREE), 7-氧代-4,5,6,7-四氢苯并[B]噻吩-3-羧酸.
Category: Organic Chemicals.
Independent reference data for 7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid(SALTDATA: FREE) (CAS 96334-46-2), compiled from public chemistry databases.
| CAS 号 | 96334-46-2 |
|---|---|
| PubChem CID | 3860983 |
| 分子式 | C9H8O3S |
| IUPAC 名称 | 7-oxo-5,6-dihydro-4H-1-benzothiophene-3-carboxylic acid |
| Molecular Weight | 196.22 |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 196.01941529 |
| Monoisotopic Mass | 196.01941529 |
| Topological Polar Surface Area | 82.6 |
| Heavy Atom Count | 13 |
96334-46-2; DTXSID30397495; STK279704; RefChem:382162; DTXCID60348354; 7-oxo-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid; 7-Oxo-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid; MFCD00715704; 7-oxo-5,6-dihydro-4H-1-benzothiophene-3-carboxylic acid; SCHEMBL5355928; 7-oxo-5,6-dihydro-4H-benzothiophene-3-carboxylic Acid; DIHMRAKCRQYYNP-UHFFFAOYSA-N; SBB080931; AKOS000275753; AS-10009; CS-0367505
7-氧代-4,5,6,7-四氢苯并[B]噻吩-3-羧酸 · CAS 96334-46-2 · C9H8O3S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.