5-(Hydroxymethyl)-3-phenyl-4-isoxazolecarboxylic acid ethyl ester (CAS 95104-44-2) — formula C13H13NO4, molecular weight 247.25; category organic chemicals.
| CAS Number | 95104-44-2 |
|---|---|
| Molecular Formula | C13H13NO4 |
| Molecular Weight | 247.25 |
| LogP | 1.4 |
| Category | Organic Chemicals |
5-(Hydroxymethyl)-3-phenyl-4-isoxazolecarboxylic acid ethyl ester is a carbon-based organic compound with CAS registry number 95104-44-2 and molecular formula C13H13NO4 (molecular weight 247.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 95104-44-2
Its molecular formula C13H13NO4 comprises 13 C, 13 H, 1 N, 4 O atoms.
Also known as: 5-(Hydroxymethyl)-3-phenyl-4-isoxazolecarboxylic acid ethyl ester · 5-(羟基甲基)-3-苯基-4-异恶唑羧酸乙酯
Category: organic chemicals
The CAS registry number of 5-(Hydroxymethyl)-3-phenyl-4-isoxazolecarboxylic acid ethyl ester is 95104-44-2.
Molecular formula C13H13NO4, molecular weight 247.25.
It is also registered under: 5-(Hydroxymethyl)-3-phenyl-4-isoxazolecarboxylic acid ethyl ester, 5-(羟基甲基)-3-苯基-4-异恶唑羧酸乙酯.
Category: Organic Chemicals.
Independent reference data for 5-(Hydroxymethyl)-3-phenyl-4-isoxazolecarboxylic acid ethyl ester (CAS 95104-44-2), compiled from public chemistry databases.
| CAS 号 | 95104-44-2 |
|---|---|
| PubChem CID | 13321086 |
| 分子式 | C13H13NO4 |
| IUPAC 名称 | ethyl 5-(hydroxymethyl)-3-phenyl-1,2-oxazole-4-carboxylate |
| Molecular Weight | 247.25 |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 247.08445790 |
| Monoisotopic Mass | 247.08445790 |
| Topological Polar Surface Area | 72.6 |
| Heavy Atom Count | 18 |
95104-44-2; Ethyl 5-(hydroxymethyl)-3-phenylisoxazole-4-carboxylate; ethyl 5-(hydroxymethyl)-3-phenyl-1,2-oxazole-4-carboxylate; 5-(Hydroxymethyl)-3-phenyl-4-isoxazolecarboxylic acid ethyl ester; SCHEMBL535741; MFCD22123831; BS-41904; DB-263350; CS-0039150; W11567; ethyl 5-(hydroxymethyl)-3-phenyl-isoxazole-4-carboxylate; Ethyl5-(hydroxymethyl)-3-phenylisoxazole-4-carboxylate; 4-Isoxazolecarboxylic acid, 5-(hydroxymethyl)-3-phenyl-, ethyl ester
5-(羟基甲基)-3-苯基-4-异恶唑羧酸乙酯 · CAS 95104-44-2 · C13H13NO4.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5-(羟基甲基)-3-苯基-4-异恶唑羧酸乙酯