5-Amino-4-cyano-3-isoxazolecarboxylic acid ethyl ester (CAS 96129-39-4) — formula C7H7N3O3, molecular weight 181.15; category organic chemicals.
| CAS Number | 96129-39-4 |
|---|---|
| Molecular Formula | C7H7N3O3 |
| Molecular Weight | 181.15 |
| LogP | 0.8 |
| Category | Organic Chemicals |
5-Amino-4-cyano-3-isoxazolecarboxylic acid ethyl ester is a carbon-based organic compound with CAS registry number 96129-39-4 and molecular formula C7H7N3O3 (molecular weight 181.15), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96129-39-4
Its molecular formula C7H7N3O3 comprises 7 C, 7 H, 3 N, 3 O atoms.
Also known as: 5-Amino-4-cyano-3-isoxazolecarboxylic acid ethyl ester · 5-氨基-4-氰基-3-异恶唑甲酸乙酯
Category: organic chemicals
The CAS registry number of 5-Amino-4-cyano-3-isoxazolecarboxylic acid ethyl ester is 96129-39-4.
Molecular formula C7H7N3O3, molecular weight 181.15.
It is also registered under: 5-Amino-4-cyano-3-isoxazolecarboxylic acid ethyl ester, 5-氨基-4-氰基-3-异恶唑甲酸乙酯.
Category: Organic Chemicals.
Independent reference data for 5-Amino-4-cyano-3-isoxazolecarboxylic acid ethyl ester (CAS 96129-39-4), compiled from public chemistry databases.
| CAS 号 | 96129-39-4 |
|---|---|
| PubChem CID | 2739975 |
| 分子式 | C7H7N3O3 |
| IUPAC 名称 | ethyl 5-amino-4-cyano-1,2-oxazole-3-carboxylate |
| UNII（FDA） | HMS1449A21 |
| Molecular Weight | 181.15 |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 181.04874109 |
| Monoisotopic Mass | 181.04874109 |
| Topological Polar Surface Area | 102 |
| Heavy Atom Count | 13 |
ethyl 5-amino-4-cyanoisoxazole-3-carboxylate; RefChem:595677; 851-976-7; 96129-39-4; ethyl 5-amino-4-cyano-1,2-oxazole-3-carboxylate; 5-amino-4-cyano-3-isoxazolecarboxylic acid ethyl ester; MFCD00110100; Maybridge3_006357; SCHEMBL5028417; DTXSID10372346; HMS1449A21; WDA12939; CCG-49374; 5-amino-4-cyano-3-carbethoxyisoxazole; AKOS015919428; IDI1_017744
| 已通报的危害声明 | H302 (100%), H312 (100%), H315 (100%), H319 (100%), H332 (100%), H335 (100%) |
|---|
5-氨基-4-氰基-3-异恶唑甲酸乙酯 · CAS 96129-39-4 · C7H7N3O3. UNII HMS1449A21.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5-氨基-4-氰基-3-异恶唑甲酸乙酯