3-[5-(4-CHLORO-BENZYLIDENE)-4-OXO-2-THIOXO-THIAZOLIDIN-3-YL]-PROPIONIC ACID (CAS 7177-97-1) — formula C13H10ClNO3S2, molecular weight 327.8; category organic chemicals.
| CAS Number | 7177-97-1 |
|---|---|
| Molecular Formula | C13H10ClNO3S2 |
| Molecular Weight | 327.8 |
| LogP | 3.1 |
| Category | Organic Chemicals |
3-[5-(4-CHLORO-BENZYLIDENE)-4-OXO-2-THIOXO-THIAZOLIDIN-3-YL]-PROPIONIC ACID is a carbon-based organic compound with CAS registry number 7177-97-1 and molecular formula C13H10ClNO3S2 (molecular weight 327.8), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 7177-97-1
Its molecular formula C13H10ClNO3S2 comprises 13 C, 10 H, 1 Cl, 1 N, 3 O, 2 S atoms.
Also known as: 3-[5-(4-CHLORO-BENZYLIDENE)-4-OXO-2-THIOXO-THIAZOLIDIN-3-YL]-PROPIONIC ACID · 3-[5-(4-氯亚苄基)-4-氧代-2-硫氧代-3-噻唑烷]-丙酸
Category: organic chemicals
The CAS registry number of 3-[5-(4-CHLORO-BENZYLIDENE)-4-OXO-2-THIOXO-THIAZOLIDIN-3-YL]-PROPIONIC ACID is 7177-97-1.
Molecular formula C13H10ClNO3S2, molecular weight 327.8.
It is also registered under: 3-[5-(4-CHLORO-BENZYLIDENE)-4-OXO-2-THIOXO-THIAZOLIDIN-3-YL]-PROPIONIC ACID, 3-[5-(4-氯亚苄基)-4-氧代-2-硫氧代-3-噻唑烷]-丙酸.
Category: Organic Chemicals.
Independent reference data for 3-[5-(4-CHLORO-BENZYLIDENE)-4-OXO-2-THIOXO-THIAZOLIDIN-3-YL]-PROPIONIC ACID (CAS 7177-97-1), compiled from public chemistry databases.
| CAS 号 | 7177-97-1 |
|---|---|
| PubChem CID | 1201122 |
| 分子式 | C13H10ClNO3S2 |
| IUPAC 名称 | 3-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid |
| UNII（FDA） | ST50035679 |
| Molecular Weight | 327.8 |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 326.9790632 |
| Monoisotopic Mass | 326.9790632 |
| Topological Polar Surface Area | 115 |
| Heavy Atom Count | 20 |
3-[5-(4-Chloro-benzylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]-propionic acid; 7177-97-1; 3-[(5Z)-5-[(4-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid; (Z)-3-(5-(4-chlorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoic acid; 1641543-78-3; CHEMBL4216670; C13H10ClNO3S2; 3-{5-[(4-chlorophenyl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoic acid; BDBM50455263; NSC830607; STK795420; AKOS000121742; NSC-830607; CS-0346061; ST50035679; EN300-00757
3-[5-(4-氯亚苄基)-4-氧代-2-硫氧代-3-噻唑烷]-丙酸 · CAS 7177-97-1 · C13H10ClNO3S2. UNII ST50035679.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.