5-Ethoxycarbonyl-4-(trifluoromethyl)pyrimidin-2(1H)-one (CAS 154934-97-1) — formula C8H7F3N2O3, molecular weight 236.15; category organic chemicals.
| CAS Number | 154934-97-1 |
|---|---|
| Molecular Formula | C8H7F3N2O3 |
| Molecular Weight | 236.15 |
| LogP | 0.6 |
| Category | Organic Chemicals |
5-Ethoxycarbonyl-4-(trifluoromethyl)pyrimidin-2(1H)-one is a carbon-based organic compound with CAS registry number 154934-97-1 and molecular formula C8H7F3N2O3 (molecular weight 236.15), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 154934-97-1
Its molecular formula C8H7F3N2O3 comprises 8 C, 7 H, 3 F, 2 N, 3 O atoms.
Also known as: 5-Ethoxycarbonyl-4-(trifluoromethyl)pyrimidin-2(1H)-one · 5-乙氧基羰基-4-(三氟甲基)嘧啶-2(1H)-酮
Category: organic chemicals
The CAS registry number of 5-Ethoxycarbonyl-4-(trifluoromethyl)pyrimidin-2(1H)-one is 154934-97-1.
Molecular formula C8H7F3N2O3, molecular weight 236.15.
It is also registered under: 5-Ethoxycarbonyl-4-(trifluoromethyl)pyrimidin-2(1H)-one, 5-乙氧基羰基-4-(三氟甲基)嘧啶-2(1H)-酮.
Category: Organic Chemicals.
Independent reference data for 5-Ethoxycarbonyl-4-(trifluoromethyl)pyrimidin-2(1H)-one (CAS 154934-97-1), compiled from public chemistry databases.
| CAS Registry Number | 154934-97-1 |
|---|---|
| PubChem CID | 2737148 |
| Molecular formula | C8H7F3N2O3 |
| IUPAC name | ethyl 2-oxo-6-(trifluoromethyl)-1H-pyrimidine-5-carboxylate |
| Molecular Weight | 236.15 |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 236.04087658 |
| Monoisotopic Mass | 236.04087658 |
| Topological Polar Surface Area | 67.8 |
| Heavy Atom Count | 16 |
154934-97-1; Ethyl 2-oxo-6-(trifluoromethyl)-1,2-dihydropyrimidine-5-carboxylate; DTXSID50371873; RefChem:342952; DTXCID50322906; ethyl 2-hydroxy-4-(trifluoromethyl)pyrimidine-5-carboxylate; 5-ethoxycarbonyl-4-(trifluoromethyl)pyrimidin-2(1h)-one; Ethyl 2-hydroxy-4-trifluoromethylpyrimidine-5-carboxylate; 2-Hydroxy-4-trifluoromethyl-pyrimidine-5-carboxylic acid ethyl ester; ethyl 2-hydroxy-4-(trifluoromethyl)-5-pyrimidinecarboxylate; 5-Ethoxycarbonyl-4-(trifluoromethyl)-pyrimidin-2-(1H)-one; ethyl 2-oxo-6-(trifluoromethyl)-1H-pyrimidine-5-carboxylate; Ethyl 2-oxo-4-(trifluoromethyl)-1,2-dihydropyrimidine-5-carboxylate; 5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-6-(trifluoromethyl)-, ethyl ester; MFCD12547939; Maybridge1_003966
| Reported hazard statements | H302 (100%), H312 (100%), H315 (100%), H319 (100%), H332 (100%), H335 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
5-Ethoxycarbonyl-4-(trifluoromethyl)pyrimidin-2(1H)-one · CAS 154934-97-1 · C8H7F3N2O3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.