4,4,5,5,6,6,6-HEPTAFLUORO-1-PHENYL-1,3-HEXANEDIONE (CAS 53580-21-5) — formula C12H7F7O2, molecular weight 316.17; category organic chemicals.
| CAS Number | 53580-21-5 |
|---|---|
| Molecular Formula | C12H7F7O2 |
| Molecular Weight | 316.17 |
| LogP | 3.9 |
| Category | Organic Chemicals |
4,4,5,5,6,6,6-HEPTAFLUORO-1-PHENYL-1,3-HEXANEDIONE is a carbon-based organic compound with CAS registry number 53580-21-5 and molecular formula C12H7F7O2 (molecular weight 316.17), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 53580-21-5
Its molecular formula C12H7F7O2 comprises 12 C, 7 H, 7 F, 2 O atoms.
Also known as: 4,4,5,5,6,6,6-HEPTAFLUORO-1-PHENYL-1,3-HEXANEDIONE · 4,4,5,5,6,6,6-七氟-1-苯基-1,3-己二酮
Category: organic chemicals
The CAS registry number of 4,4,5,5,6,6,6-HEPTAFLUORO-1-PHENYL-1,3-HEXANEDIONE is 53580-21-5.
Molecular formula C12H7F7O2, molecular weight 316.17.
It is also registered under: 4,4,5,5,6,6,6-HEPTAFLUORO-1-PHENYL-1,3-HEXANEDIONE, 4,4,5,5,6,6,6-七氟-1-苯基-1,3-己二酮.
Category: Organic Chemicals.
Independent reference data for 4,4,5,5,6,6,6-HEPTAFLUORO-1-PHENYL-1,3-HEXANEDIONE (CAS 53580-21-5), compiled from public chemistry databases.
| CAS 号 | 53580-21-5 |
|---|---|
| PubChem CID | 2782584 |
| 分子式 | C12H7F7O2 |
| IUPAC 名称 | 4,4,5,5,6,6,6-heptafluoro-1-phenylhexane-1,3-dione |
| UNII（FDA） | NS00111918 |
| Molecular Weight | 316.17 |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 5 |
| Exact Mass | 316.03342660 |
| Monoisotopic Mass | 316.03342660 |
| Topological Polar Surface Area | 34.1 |
| Heavy Atom Count | 21 |
53580-21-5; 4,4,5,5,6,6,6-heptafluoro-1-phenylhexane-1,3-dione; DTXSID90382160; RefChem:284740; DTXCID20333185; 4,4,5,5,6,6,6-Heptafluoro-1-phenyl-1,3-hexanedione; 1-Phenyl-2H,2H-perfluorohexane-1,3-dione; MFCD00511283; SCHEMBL2262230; C12H7F7O2; 4,4,5,5,6,6,6-heptafluoro-1-phenyl-hexane-1,3-dione; HNYZQPXURIQQJV-UHFFFAOYSA-N; AKOS015852771; DB-348885; NS00111918
4,4,5,5,6,6,6-七氟-1-苯基-1,3-己二酮 · CAS 53580-21-5 · C12H7F7O2. UNII NS00111918.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.