(Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate
TL;DR: (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate (CAS 101711-02-8) is a chemical compound with molecular formula C17H19NO3 and molecular weight 285.1365 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pyridin-2-ylmethyl 2-hydroxy-3-methyl-2-phenylbutanoate
Also Known As: 2-Pyridinemethyl alpha-isopropyl-alpha-phenylglycolate, (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate, MANDELIC ACID, alpha-ISOPROPYL-, 2-PYRIDYLMETHYL ESTER, pyridin-2-ylmethyl 2-hydroxy-3-methyl-2-phenylbutanoate, alpha-Hydroxy-alpha-isopropylbenzeneacetic acid 2-pyridylmethyl ester
Technical Specifications
| Molecular Formula | C17H19NO3 |
| Molecular Weight | 285.1365 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 59.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.1365 Da |
| Heavy Atoms | 21 |
| Complexity | 339.0 |
| SMILES | CC(C)C(C1=CC=CC=C1)(C(=O)OCC2=CC=CC=N2)O |
| InChIKey | FLUMCGBIBFGWKF-UHFFFAOYSA-N |
Chemical Property Profile of (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate
Property Insights of (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate. With a topological polar surface area (TPSA) of 59.4 Ų, (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate 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 (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate?
The CAS number of (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate is 101711-02-8.
What is the molecular formula of (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate?
The molecular formula of (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate is C17H19NO3.
What is the molecular weight of (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate?
The molecular weight of (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate is 285.1365 g/mol.
Where can I buy (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate?
You can request a quote for (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate?
Yes, CoreyChem provides custom synthesis services for (Pyridin-2-yl)methyl 2-hydroxy-3-methyl-2-phenylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.