2,3-Pinanediol
TL;DR: 2,3-Pinanediol (CAS 53404-49-2) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol
Also Known As: 2,3-Pinanediol, DHS Activator, sodiumcarbonate, Pinolol, Pinene diol
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 53404-49-2 |
|---|---|
| SMILES | CC1(C2CC1C(C(C2)O)(C)O)C |
| InChIKey | MOILFCKRQFQVFS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Pinanediol (CAS 53404-49-2), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: 2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol.
Chemical Property Profile of 2,3-Pinanediol
Property Insights of 2,3-Pinanediol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Pinanediol. With a topological polar surface area (TPSA) of 40.5 Ų, 2,3-Pinanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Pinanediol has 2 hydrogen bond donor(s) and 2 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 2,3-Pinanediol?
The CAS number of 2,3-Pinanediol is 53404-49-2.
What is the molecular formula of 2,3-Pinanediol?
The molecular formula of 2,3-Pinanediol is C10H18O2.
What is the molecular weight of 2,3-Pinanediol?
The molecular weight of 2,3-Pinanediol is 170.13 g/mol.
Where can I buy 2,3-Pinanediol?
You can request a quote for 2,3-Pinanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Pinanediol?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Pinanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.