
CAS Number38363-40-5
Synonyms(2R)-1-(tert-butylamino)-3-(2-cyclopentylphenoxy)propan-2-ol; (+)-Penbutolol; 2-Propanol, 1-(2-cyclopentylphenoxy)-3-((1,1-dimethylethyl)amino)-, (R)-; C07416; Penbutolol
Molecular FormulaC18H29NO2
Molecular Weight680.94
Purity98.00%
Density1.03g/cm3
Boiling Point438.2ºC at 760mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 38363-40-5 |
| Catalog No. | 2A-9011909 |
| Chinese Name | 喷布洛尔 |
| Synonyms | (2R)-1-(tert-butylamino)-3-(2-cyclopentylphenoxy)propan-2-ol; (+)-Penbutolol; 2-Propanol, 1-(2-cyclopentylphenoxy)-3-((1,1-dimethylethyl)amino)-, (R)-; C07416; Penbutolol |
| Molecular Formula | C18H29NO2 |
| Molecular Weight | 680.94 |
| Purity | 98.00 |
| Density | 1.03g/cm3 |
| Boiling Point | 438.2ºC at 760mmHg |
| Application | (-)-Pentolol ((S)-Pentbutrolol) is a potent beta-adrenergic receptor and 5-HT receptor antagonist. The Ki values of 5-HT in rat ammonium 1 (CA1) and human CA3 are 11.6nM and 11.9nM respectively. (-) |
| SMILES | [S](=O)(=O)(O)O.N(C[C@H](O)COc3c(cccc3)C4CCCC4)C(C)(C)C.N(C[C@H](O)COc1c(cccc1)C2CCCC2)C(C)(C)C |
| InChI | 1S/2C18H29NO2.H2O4S/c2*1-18(2,3)19-12-15(20)13-21-17-11-7-6-10-16(17)14-8-4-5-9-14;1-5(2,3)4/h2*6-7,10-11,14-15,19-20H,4-5,8-9,12-13H2,1-3H3;(H2,1,2,3,4)/t2*15-;/m00./s1 |
| InChI Key | FEDSNBHHWZEYTP-ZFQYHYQMSA-N |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
| MSDS | msds/11909_1_38363_40_5.pdf |
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