4,4,4-trifluorobutyraldehyde (CAS 406-87-1) — formula C4H5F3O, molecular weight 126.08; category organic chemicals.
| CAS Number | 406-87-1 |
|---|---|
| Molecular Formula | C4H5F3O |
| Molecular Weight | 126.08 |
| LogP | 1.1 |
| Category | Organic Chemicals |
4,4,4-trifluorobutyraldehyde is a carbon-based organic compound with CAS registry number 406-87-1 and molecular formula C4H5F3O (molecular weight 126.08), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 406-87-1
Its molecular formula C4H5F3O comprises 4 C, 5 H, 3 F, 1 O atoms.
Also known as: 4,4,4-trifluorobutyraldehyde · 4,4,4-三氟丁醛
Category: organic chemicals
The CAS registry number of 4,4,4-trifluorobutyraldehyde is 406-87-1.
Molecular formula C4H5F3O, molecular weight 126.08.
It is also registered under: 4,4,4-trifluorobutyraldehyde, 4,4,4-三氟丁醛.
Category: Organic Chemicals.
Independent reference data for 4,4,4-trifluorobutyraldehyde (CAS 406-87-1), compiled from public chemistry databases.
| CAS Registry Number | 406-87-1 |
|---|---|
| PubChem CID | 2777083 |
| Molecular formula | C4H5F3O |
| IUPAC name | 4,4,4-trifluorobutanal |
| Molecular Weight | 126.08 |
|---|---|
| XLogP3 | 1.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 126.02924926 |
| Monoisotopic Mass | 126.02924926 |
| Topological Polar Surface Area | 17.1 |
| Heavy Atom Count | 8 |
4,4,4-trifluorobutanal; 406-87-1; DTXSID10380365; RefChem:284715; DTXCID50331391; 691-630-0; 4,4,4-trifluorobutyraldehyde; MFCD00190643; 4,4,4-Trifluorobutyraldehyde, tech.; 4,4,4-trifluoro-butyraldehyde; Butanal,4,4,4-trifluoro-; Butanal, 4,4,4-trifluoro-; 4,4,4-Trifluorobutanal 95%; 4,4,4-trifluoro-1-butanal; SCHEMBL285606; SCHEMBL605855
| Reported hazard statements | H225 (33.3%), H226 (50%), H315 (83.3%), H319 (100%), H335 (100%) |
|---|
H225 (33.3%): Highly Flammable liquid and vapor [Danger Flammable liquids]
H226 (50%): Flammable liquid and vapor [Warning Flammable liquids]
4,4,4-trifluorobutyraldehyde · CAS 406-87-1 · C4H5F3O.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4,4,4-三氟丁醛