倍他洛尔(CAS 63659-18-7):分子式 C18H29NO3、分子量 307.4。
| CAS号 | 63659-18-7 |
|---|---|
| 分子式 | C18H29NO3 |
| 分子量 | 307.4 |
| 熔点 | 70-72 °C |
| LogP | 2.81 |
| 应用领域 | Uses: Use (kg、approx.) in Germany (2009): >100、Consumption (g per capita、approx.) in Germany (2009): 0.00122、Calculated removal (%): 27.6、Use Classification: Pharmaceuticals |
登记用途:Uses: Use (kg、approx.) in Germany (2009): >100、Consumption (g per capita、approx.) in Germany (2009): 0.00122、Calculated removal (%): 27.6、Use Classification: Pharmaceuticals。
倍他洛尔 是一种化工化合物,登记 CAS 号为 63659-18-7,分子式 C18H29NO3(分子量 307.4)。
登记 CAS 号:63659-18-7
其分子式 C18H29NO3 由 18 个碳、29 个氢、1 个氮、3 个氧 组成。
别名/同义词:倍他洛尔 · Betaxolol
倍他洛尔 的 CAS 登记号为 63659-18-7。
分子式 C18H29NO3,分子量 307.4。
别名/同义词:倍他洛尔、Betaxolol。
登记用途:Uses: Use (kg、approx.) in Germany (2009): >100、Consumption (g per capita、approx.) in Germany (2009): 0.00122、Calculated removal (%): 27.6、Use Classification: Pharmaceuticals。
倍他洛尔(CAS 63659-18-7)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 63659-18-7 |
|---|---|
| PubChem CID | 2369 |
| Molecular formula | C18H29NO3 |
| IUPAC name | 1-[4-[2-(cyclopropylmethoxy)ethyl]phenoxy]-3-(propan-2-ylamino)propan-2-ol |
| UNII (FDA) | O0ZR1R6RZ2 |
| Molecular Weight | 307.4 |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 11 |
| Exact Mass | 307.21474379 |
| Monoisotopic Mass | 307.21474379 |
| Topological Polar Surface Area | 50.7 |
| Heavy Atom Count | 22 |
| Melting Point | 70-72 °C |
|---|---|
| Melting Point | 70 - 72 °C |
| Solubility | 451 |
| Solubility | 2.98e-02 g/L |
| LogP | 2.81 |
| LogP | 2.4 |
| Dissociation Constants | 9.21 |
| Dissociation Constants | 9.4 |
betaxolol; 63659-18-7; Betaxololum; DTXSID2022674; SL 75212; O0ZR1R6RZ2; 1-[4-[2-(cyclopropylmethoxy)ethyl]phenoxy]-3-(propan-2-ylamino)propan-2-ol; 1-(4-(2-(Cyclopropylmethoxy)ethyl)phenoxy)-3-((1-methylethyl)amino)-2-propanol; ALO-140102 FREE BASE; 2-Propanol, 1-(4-(2-(cyclopropylmethoxy)ethyl)phenoxy)-3-((1-methylethyl)amino)-; SL-7521210 FREE BASE; CHEBI:3082; DTXCID102674; 1-(isopropylamino)-3-[p-(cyclopropylmethoxyethyl)phenoxy]-2-propanol; 1-{4-[2-(Cyclopropylmethoxy)ethyl]phenoxy}-3-[(propan-2-yl)amino]propan-2-ol; 1-{4-[2-(cyclopropylmethoxy)ethyl]phenoxy}-3-(propan-2-ylamino)propan-2-ol
| Reported hazard statements | H302 (100%), H361 (100%), H412 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H361 (100%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]
Betaxolol · CAS 63659-18-7 · C18H29NO3. UNII O0ZR1R6RZ2. Melting Point: 70-72 °C; Melting Point: 70 - 72 °C; Solubility: 451.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: Betaxolol