Pyridin-3-ylmethanediol
TL;DR: Pyridin-3-ylmethanediol (CAS 105868-53-9) is a chemical compound with molecular formula C6H7NO2 and molecular weight 125.047676 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pyridin-3-ylmethanediol
Also Known As: Pyridin-3-ylmethanediol, 3-Pyridinylmethanediol, Methanediol, 3-pyridinyl-, Methanediol, 3-pyridinyl-(9CI), (PYRIDIN-3-YL)METHANEDIOL
Technical Specifications
| Molecular Formula | C6H7NO2 |
| Molecular Weight | 125.047676 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 53.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 125.047676 Da |
| Heavy Atoms | 9 |
| Complexity | 85.0 |
| SMILES | C1=CC(=CN=C1)C(O)O |
| InChIKey | CTZBYLVHJHSEPX-UHFFFAOYSA-N |
Chemical Property Profile of Pyridin-3-ylmethanediol
Property Insights of Pyridin-3-ylmethanediol
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridin-3-ylmethanediol. With a topological polar surface area (TPSA) of 53.4 Ų, Pyridin-3-ylmethanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridin-3-ylmethanediol has 2 hydrogen bond donor(s) and 3 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-3-ylmethanediol?
The CAS number of Pyridin-3-ylmethanediol is 105868-53-9.
What is the molecular formula of Pyridin-3-ylmethanediol?
The molecular formula of Pyridin-3-ylmethanediol is C6H7NO2.
What is the molecular weight of Pyridin-3-ylmethanediol?
The molecular weight of Pyridin-3-ylmethanediol is 125.047676 g/mol.
Where can I buy Pyridin-3-ylmethanediol?
You can request a quote for Pyridin-3-ylmethanediol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pyridin-3-ylmethanediol?
Yes, CoreyChem provides custom synthesis services for Pyridin-3-ylmethanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.