Ethyl-2-phenyl-2-cyanobutylate (CAS 718-71-8) — formula C13H15NO2, molecular weight 217.26; category organic chemicals.
| CAS Number | 718-71-8 |
|---|---|
| Molecular Formula | C13H15NO2 |
| Molecular Weight | 217.26 |
| LogP | 2.8 |
| Category | Organic Chemicals |
Ethyl-2-phenyl-2-cyanobutylate is a carbon-based organic compound with CAS registry number 718-71-8 and molecular formula C13H15NO2 (molecular weight 217.26), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 718-71-8
Its molecular formula C13H15NO2 comprises 13 C, 15 H, 1 N, 2 O atoms.
Also known as: Ethyl-2-phenyl-2-cyanobutylate · 2-苯基-2-氰基丁酸乙酯
Category: organic chemicals
The CAS registry number of Ethyl-2-phenyl-2-cyanobutylate is 718-71-8.
Molecular formula C13H15NO2, molecular weight 217.26.
It is also registered under: Ethyl-2-phenyl-2-cyanobutylate, 2-苯基-2-氰基丁酸乙酯.
Category: Organic Chemicals.
Independent reference data for Ethyl-2-phenyl-2-cyanobutylate (CAS 718-71-8), compiled from public chemistry databases.
| CAS Registry Number | 718-71-8 |
|---|---|
| PubChem CID | 250114 |
| Molecular formula | C13H15NO2 |
| IUPAC name | ethyl 2-cyano-2-phenylbutanoate |
| UNII (FDA) | K9W88T87XA |
| Molecular Weight | 217.26 |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 5 |
| Exact Mass | 217.110278721 |
| Monoisotopic Mass | 217.110278721 |
| Topological Polar Surface Area | 50.1 |
| Heavy Atom Count | 16 |
ethyl 2-cyano-2-phenylbutanoate; 718-71-8; NSC-69121; K9W88T87XA; DTXSID60290526; Ethyl alpha-cyano-alpha-ethylbenzeneacetate; RefChem:1085018; DTXCID40241672; 700-275-3; ETHYL CYANOETHYLPHENYLACETATE; MFCD00068977; SCHEMBL9214363; EC 700-275-3; Ethyl-2-phenyl-2-cyanobutylate; NSC 69121; Ethylphenylcyano-acetic acid ethyl ester
| Reported hazard statements | H315 (50%), H319 (50%), H361 (50%) |
|---|
H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Ethyl-2-phenyl-2-cyanobutylate · CAS 718-71-8 · C13H15NO2. UNII K9W88T87XA.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-苯基-2-氰基丁酸乙酯