1,3-Diphenyl-1,3-propanediol
TL;DR: 1,3-Diphenyl-1,3-propanediol (CAS 139165-57-4) is a chemical compound with molecular formula C15H16O2 and molecular weight 228.11504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-diphenylpropane-1,3-diol
Also Known As: 1,3-diphenylpropane-1,3-diol, 1,3-Diphenyl-1,3-propanediol, 1,3-diphenyl-1,3-propandiol, 1,3-diphenyl-propane-1,3-diol, 1,3-Propanediol,1,3-diphenyl-
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H16O2 |
| Molecular Weight | 228.11504 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 228.11504 Da |
| Heavy Atoms | 17 |
| Complexity | 183.0 |
| SMILES | C1=CC=C(C=C1)C(CC(C2=CC=CC=C2)O)O |
| InChIKey | XHHXJXGIYFQFOQ-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Diphenyl-1,3-propanediol
Property Insights of 1,3-Diphenyl-1,3-propanediol
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Diphenyl-1,3-propanediol. With a topological polar surface area (TPSA) of 40.5 Ų, 1,3-Diphenyl-1,3-propanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Diphenyl-1,3-propanediol 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
What is the CAS number of 1,3-Diphenyl-1,3-propanediol?
The CAS number of 1,3-Diphenyl-1,3-propanediol is 139165-57-4.
What is the molecular formula of 1,3-Diphenyl-1,3-propanediol?
The molecular formula of 1,3-Diphenyl-1,3-propanediol is C15H16O2.
What is the molecular weight of 1,3-Diphenyl-1,3-propanediol?
The molecular weight of 1,3-Diphenyl-1,3-propanediol is 228.11504 g/mol.
Where can I buy 1,3-Diphenyl-1,3-propanediol?
You can request a quote for 1,3-Diphenyl-1,3-propanediol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Diphenyl-1,3-propanediol?
Yes, CoreyChem provides custom synthesis services for 1,3-Diphenyl-1,3-propanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.