heptafluorobutyrophenone (CAS 559-91-1) — formula C10H5F7O, molecular weight 274.13; category organic chemicals.
| CAS Number | 559-91-1 |
|---|---|
| Molecular Formula | C10H5F7O |
| Molecular Weight | 274.13 |
| LogP | 4.1 |
| Applications | Use Classification: PFAS (per- and polyfluoroalkyl substances) -> OECD Category |
| Category | Organic Chemicals |
Documented applications: Use Classification: PFAS (per- and polyfluoroalkyl substances) -> OECD Category.
heptafluorobutyrophenone is a carbon-based organic compound with CAS registry number 559-91-1 and molecular formula C10H5F7O (molecular weight 274.13), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 559-91-1
Its molecular formula C10H5F7O comprises 10 C, 5 H, 7 F, 1 O atoms.
Also known as: heptafluorobutyrophenone · 七氟丁苯酮
Category: organic chemicals
The CAS registry number of heptafluorobutyrophenone is 559-91-1.
Molecular formula C10H5F7O, molecular weight 274.13.
It is also registered under: heptafluorobutyrophenone, 七氟丁苯酮.
Recorded applications: Use Classification: PFAS (per- and polyfluoroalkyl substances) -> OECD Category.
Category: Organic Chemicals.
Independent reference data for heptafluorobutyrophenone (CAS 559-91-1), compiled from public chemistry databases.
| CAS Registry Number | 559-91-1 |
|---|---|
| PubChem CID | 238424 |
| Molecular formula | C10H5F7O |
| IUPAC name | 2,2,3,3,4,4,4-heptafluoro-1-phenylbutan-1-one |
| UNII (FDA) | NS00109494 |
| Molecular Weight | 274.13 |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 3 |
| Exact Mass | 274.02286191 |
| Monoisotopic Mass | 274.02286191 |
| Topological Polar Surface Area | 17.1 |
| Heavy Atom Count | 18 |
559-91-1; Heptafluoropropyl phenyl ketone; (Heptafluorobutyro)phenone; 2,2,3,3,4,4,4-heptafluoro-1-phenylbutan-1-one; Heptafluorobutyrophenone; 2,2,3,3,4,4,4-Heptafluorobutyrophenone; MFCD00077552; phenyl heptafluoropropyl ketone; C10H5F7O; NSC42768; Perfluoropropyl phenyl ketone; SCHEMBL498072; 2,2,3,3,4,4,4-Heptafluoro-1-phenyl-butan-1-one; DTXSID20285776; NSC-42768; AKOS007930558
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
heptafluorobutyrophenone · CAS 559-91-1 · C10H5F7O. UNII NS00109494.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 七氟丁苯酮