ethyl 1-benzyl-5-hydroxy-1H-1,2,3-triazole-4-carboxylate (CAS 94158-08-4) — formula C12H13N3O3, molecular weight 247.25; category organic chemicals.
| CAS Number | 94158-08-4 |
|---|---|
| Molecular Formula | C12H13N3O3 |
| Molecular Weight | 247.25 |
| LogP | 2.1 |
| Category | Organic Chemicals |
ethyl 1-benzyl-5-hydroxy-1H-1,2,3-triazole-4-carboxylate is a carbon-based organic compound with CAS registry number 94158-08-4 and molecular formula C12H13N3O3 (molecular weight 247.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 94158-08-4
Its molecular formula C12H13N3O3 comprises 12 C, 13 H, 3 N, 3 O atoms.
Also known as: ethyl 1-benzyl-5-hydroxy-1H-1,2,3-triazole-4-carboxylate · 1-苄基-5-羟基-1H-1,2,3-三唑-4-甲酸乙酯
Category: organic chemicals
The CAS registry number of ethyl 1-benzyl-5-hydroxy-1H-1,2,3-triazole-4-carboxylate is 94158-08-4.
Molecular formula C12H13N3O3, molecular weight 247.25.
It is also registered under: ethyl 1-benzyl-5-hydroxy-1H-1,2,3-triazole-4-carboxylate, 1-苄基-5-羟基-1H-1,2,3-三唑-4-甲酸乙酯.
Category: Organic Chemicals.
Independent reference data for ethyl 1-benzyl-5-hydroxy-1H-1,2,3-triazole-4-carboxylate (CAS 94158-08-4), compiled from public chemistry databases.
| CAS 号 | 94158-08-4 |
|---|---|
| PubChem CID | 2748772 |
| 分子式 | C12H13N3O3 |
| IUPAC 名称 | ethyl 1-benzyl-5-oxo-2H-triazole-4-carboxylate |
| UNII（FDA） | NS00066038 |
| Molecular Weight | 247.25 |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 247.09569129 |
| Monoisotopic Mass | 247.09569129 |
| Topological Polar Surface Area | 71 |
| Heavy Atom Count | 18 |
94158-08-4; Ethyl 1-benzyl-5-hydroxy-1H-1,2,3-triazole-4-carboxylate; Ethyl 1-benZyl-5-hydroxy-triaZole-4-carboxylate; EINECS 303-078-7; MFCD01109286; Ethyl 5-hydroxy-1-(phenylmethyl)-1H-1,2,3-triazole-4-carboxylate; CHEMBL3741061; SCHEMBL15875618; DTXSID60916279; LVHLLQKVXQGXNU-UHFFFAOYSA-N; 5-Hydroxy-1-benzyl-1H-1,2,3-triazole-4-carboxylic acid ethyl ester; AKOS004904343; NS00066038; H54702; Ethyl 1-phenylmethyl-5-hydroxy-1,2,3-triazole-4-carboxylate; Ethyl 1-benzyl-5-oxo-2,5-dihydro-1H-1,2,3-triazole-4-carboxylate
1-苄基-5-羟基-1H-1,2,3-三唑-4-甲酸乙酯 · CAS 94158-08-4 · C12H13N3O3. UNII NS00066038.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.