2-甲基-4-氧代-2-环己烯甲酸乙酯(CAS 487-51-4):分子式 C10H14O3、分子量 182.22。
| CAS号 | 487-51-4 |
|---|---|
| 分子式 | C10H14O3 |
| 分子量 | 182.22 |
| LogP | 0.7 |
2-甲基-4-氧代-2-环己烯甲酸乙酯 是一种化工化合物,登记 CAS 号为 487-51-4,分子式 C10H14O3(分子量 182.22)。
登记 CAS 号:487-51-4
其分子式 C10H14O3 由 10 个碳、14 个氢、3 个氧 组成。
别名/同义词:2-甲基-4-氧代-2-环己烯甲酸乙酯 · ethyl 2-methyl-4-oxo-2-cyclohexene carboxylate
2-甲基-4-氧代-2-环己烯甲酸乙酯 的 CAS 登记号为 487-51-4。
分子式 C10H14O3,分子量 182.22。
别名/同义词:2-甲基-4-氧代-2-环己烯甲酸乙酯、ethyl 2-methyl-4-oxo-2-cyclohexene carboxylate。
2-甲基-4-氧代-2-环己烯甲酸乙酯(CAS 487-51-4)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 487-51-4 |
|---|---|
| PubChem CID | 79020 |
| Molecular formula | C10H14O3 |
| IUPAC name | ethyl 2-methyl-4-oxocyclohex-2-ene-1-carboxylate |
| UNII (FDA) | 5QME6N6BKP |
| Molecular Weight | 182.22 |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 182.094294304 |
| Monoisotopic Mass | 182.094294304 |
| Topological Polar Surface Area | 43.4 |
| Heavy Atom Count | 13 |
487-51-4; Ethyl 2-methyl-4-oxocyclohex-2-enecarboxylate; Hagemann's ester; 4-Carbethoxy-3-methyl-2-cyclohexen-1-one; Ethyl 2-methyl-4-oxo-2-cyclohexenecarboxylate; 5QME6N6BKP; 2-Cyclohexene-1-carboxylic acid, 2-methyl-4-oxo-, ethyl ester; Ethyl 2-methyl-4-oxo-2-cyclohexencarboxylate; Ethyl 2-methyl-4-oxo-2-cyclohexene-1-carboxylate; NSC-60294; NSC 60294; 4-ETHOXYCARBONYL-3-METHYL-2-CYCLOHEXEN-1-ONE; 2-METHYL-4-OXO-2-CYCLOHEXENE-1-CARBOXYLIC ACID ETHYL ESTER; RefChem:198628; 4Carbethoxy3methyl2cyclohexen1one; Ethyl 2methyl4oxo2cyclohexenecarboxylate
| Reported hazard statements | H315 (100%), H319 (100%), H335 (50%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
ethyl 2-methyl-4-oxo-2-cyclohexene carboxylate · CAS 487-51-4 · C10H14O3. UNII 5QME6N6BKP.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: ethyl 2-methyl-4-oxo-2-cyclohexene carboxylate