methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate
TL;DR: methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate (CAS 302776-80-3) is a chemical compound with molecular formula C17H24O4 and molecular weight 292.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(2,2-dimethyloxan-4-yl)-3-hydroxy-3-phenylpropanoate
Also Known As: AL-281/36997045, methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate, methyl 3-(2,2-dimethyloxan-4-yl)-3-hydroxy-3-phenylpropanoate
| Molecular Formula | C17H24O4 |
|---|---|
| Molecular Weight | 292.17 g/mol |
| LogP | 2.6425 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 292.16745 |
| Heavy Atoms | 21 |
| Complexity | 482.8233 |
Chemical Identifiers
| CAS Number | 302776-80-3 |
|---|---|
| SMILES | CC1(CC(CCO1)C(CC(=O)OC)(C2=CC=CC=C2)O)C |
Product Overview
methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate (CAS 302776-80-3), with molecular formula C17H24O4 and molecular weight 292.17 g/mol. IUPAC: methyl 3-(2,2-dimethyloxan-4-yl)-3-hydroxy-3-phenylpropanoate.
Chemical Property Profile of methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate
Property Insights of methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate
The XLogP value of 2.6425 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate. With a topological polar surface area (TPSA) of 55.76 Ų, methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate 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
Frequently Asked Questions
What is the CAS number of methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate?
The CAS number of methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate is 302776-80-3.
What is the molecular formula of methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate?
The molecular formula of methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate is C17H24O4.
What is the molecular weight of methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate?
The molecular weight of methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate is 292.17 g/mol.
Where can I buy methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate?
You can request a quote for methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3-hydroxy-3-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.