3-Ethyl-3-phenyl-1,5-pentanediol
TL;DR: 3-Ethyl-3-phenyl-1,5-pentanediol (CAS 84682-28-0) is a chemical compound with molecular formula C13H20O2 and molecular weight 208.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-3-phenylpentane-1,5-diol
Also Known As: 3-Ethyl-3-phenylpentane-1,5-diol, NCIOpen2_005629, 3-Ethyl-3-phenyl-1,5-pentanediol, 3-ethyl-3-phenyl-pentane-1,5-diol, 1,5-Pentanediol,3-ethyl-3-phenyl-
| Molecular Formula | C13H20O2 |
|---|---|
| Molecular Weight | 208.15 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 208.14633 |
| Heavy Atoms | 15 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 84682-28-0 |
|---|---|
| SMILES | CCC(CCO)(CCO)C1=CC=CC=C1 |
| InChIKey | JDYDBAVDWRWTCJ-UHFFFAOYSA-N |
Product Overview
3-Ethyl-3-phenyl-1,5-pentanediol (CAS 84682-28-0), with molecular formula C13H20O2 and molecular weight 208.15 g/mol. IUPAC: 3-ethyl-3-phenylpentane-1,5-diol.
Chemical Property Profile of 3-Ethyl-3-phenyl-1,5-pentanediol
Property Insights of 3-Ethyl-3-phenyl-1,5-pentanediol
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethyl-3-phenyl-1,5-pentanediol. With a topological polar surface area (TPSA) of 40.5 Ų, 3-Ethyl-3-phenyl-1,5-pentanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethyl-3-phenyl-1,5-pentanediol 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 3-Ethyl-3-phenyl-1,5-pentanediol?
The CAS number of 3-Ethyl-3-phenyl-1,5-pentanediol is 84682-28-0.
What is the molecular formula of 3-Ethyl-3-phenyl-1,5-pentanediol?
The molecular formula of 3-Ethyl-3-phenyl-1,5-pentanediol is C13H20O2.
What is the molecular weight of 3-Ethyl-3-phenyl-1,5-pentanediol?
The molecular weight of 3-Ethyl-3-phenyl-1,5-pentanediol is 208.15 g/mol.
Where can I buy 3-Ethyl-3-phenyl-1,5-pentanediol?
You can request a quote for 3-Ethyl-3-phenyl-1,5-pentanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethyl-3-phenyl-1,5-pentanediol?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-3-phenyl-1,5-pentanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.