beta-Hydroxyethylaprophen
TL;DR: beta-Hydroxyethylaprophen (CAS 133342-59-3) is a chemical compound with molecular formula C21H27NO3 and molecular weight 341.1991 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[ethyl(2-hydroxyethyl)amino]ethyl 2,2-diphenylpropanoate
Also Known As: beta-Hydroxyethylaprophen, N-Cyclohexylpropyl Deoxynojirimycin, 2-[ethyl(2-hydroxyethyl)amino]ethyl 2,2-diphenylpropanoate, N-Ethyl-N-(beta-hydroxyethyl)aminoethyl 2,2-diphenylpropionate, 2,2-Diphenylpropanoic acid 2-[ethyl(2-hydroxyethyl)amino]ethyl ester
Technical Specifications
| Molecular Formula | C21H27NO3 |
| Molecular Weight | 341.1991 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 341.1991 Da |
| Heavy Atoms | 25 |
| Complexity | 369.0 |
| SMILES | CCN(CCO)CCOC(=O)C(C)(C1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | ZWVMSGKORONRLT-UHFFFAOYSA-N |
Chemical Property Profile of beta-Hydroxyethylaprophen
Property Insights of beta-Hydroxyethylaprophen
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-Hydroxyethylaprophen. With a topological polar surface area (TPSA) of 49.8 Ų, beta-Hydroxyethylaprophen exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Hydroxyethylaprophen has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of beta-Hydroxyethylaprophen?
The CAS number of beta-Hydroxyethylaprophen is 133342-59-3.
What is the molecular formula of beta-Hydroxyethylaprophen?
The molecular formula of beta-Hydroxyethylaprophen is C21H27NO3.
What is the molecular weight of beta-Hydroxyethylaprophen?
The molecular weight of beta-Hydroxyethylaprophen is 341.1991 g/mol.
Where can I buy beta-Hydroxyethylaprophen?
You can request a quote for beta-Hydroxyethylaprophen directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for beta-Hydroxyethylaprophen?
Yes, CoreyChem provides custom synthesis services for beta-Hydroxyethylaprophen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.