3-ACETYL-5-(P-FLUOROBENZYLIDENE)-4-HYDROXY-2(5H)-THIOPHENONE (CAS 5518-90-1) — formula C13H9FO3S, molecular weight 264.27; category organic chemicals.
| CAS Number | 5518-90-1 |
|---|---|
| Molecular Formula | C13H9FO3S |
| Molecular Weight | 264.27 |
| LogP | 2.8 |
| Category | Organic Chemicals |
3-ACETYL-5-(P-FLUOROBENZYLIDENE)-4-HYDROXY-2(5H)-THIOPHENONE is a carbon-based organic compound with CAS registry number 5518-90-1 and molecular formula C13H9FO3S (molecular weight 264.27), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5518-90-1
Its molecular formula C13H9FO3S comprises 13 C, 9 H, 1 F, 3 O, 1 S atoms.
Also known as: 3-ACETYL-5-(P-FLUOROBENZYLIDENE)-4-HYDROXY-2(5H)-THIOPHENONE · 3-乙酰基-5-(对氟亚苄基)-4-羟基-2(5H)-噻吩酮
Category: organic chemicals
The CAS registry number of 3-ACETYL-5-(P-FLUOROBENZYLIDENE)-4-HYDROXY-2(5H)-THIOPHENONE is 5518-90-1.
Molecular formula C13H9FO3S, molecular weight 264.27.
It is also registered under: 3-ACETYL-5-(P-FLUOROBENZYLIDENE)-4-HYDROXY-2(5H)-THIOPHENONE, 3-乙酰基-5-(对氟亚苄基)-4-羟基-2(5H)-噻吩酮.
Category: Organic Chemicals.
Independent reference data for 3-ACETYL-5-(P-FLUOROBENZYLIDENE)-4-HYDROXY-2(5H)-THIOPHENONE (CAS 5518-90-1), compiled from public chemistry databases.
| CAS 号 | 5518-90-1 |
|---|---|
| PubChem CID | 135570597 |
| 分子式 | C13H9FO3S |
| IUPAC 名称 | (5Z)-3-acetyl-5-[(4-fluorophenyl)methylidene]-4-hydroxythiophen-2-one |
| Molecular Weight | 264.27 |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 264.02564348 |
| Monoisotopic Mass | 264.02564348 |
| Topological Polar Surface Area | 79.7 |
| Heavy Atom Count | 18 |
ICI 47776; 5518-90-1; RefChem:1087142; 3-Acetyl-5-(4-Fluorobenzylidene)-4-Hydroxy-2(5H)-Thiophenone; 3-Acetyl-5-(p-fluorobenzylidene)-4-hydroxy-2(5H)-thiophenone; BRN 1249699; 3-Acetyl-5-p-fluorobenzylidene-2,5-dihydro-4-hydroxy-2-oxothiophen; 2(5H)-Thiophenone, 3-acetyl-5-(p-fluorobenzylidene)-4-hydroxy-; 2(5H)-Thiophene, 3-acetyl-5-((4-fluorophenyl)methylene)-4-hydroxy-; 2,4-Pentadienoic acid, 2-acetyl-5-(p-fluorophenyl)-3-hydroxy-4-mercapto-, gamma-(thio lactone); CHEMBL313410; SCHEMBL10457389
3-乙酰基-5-(对氟亚苄基)-4-羟基-2(5H)-噻吩酮 · CAS 5518-90-1 · C13H9FO3S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.