Octadecane-2,3-diol
TL;DR: Octadecane-2,3-diol (CAS 78709-62-3) is a chemical compound with molecular formula C18H38O2 and molecular weight 286.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R)-octadecane-2,3-diol
Also Known As: Octadecane-2,3-diol, (2s,3r)-octadecane-2,3-diol, 2,3-Octadecanediol, (R*,S*)-(+-)-, 5-methyl-1-p-tolyl-1,2-dihydro-pyrazol-3-one, RefChem:167599
| Molecular Formula | C18H38O2 |
|---|---|
| Molecular Weight | 286.29 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 286.28717 |
| Heavy Atoms | 20 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 78709-62-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCC[C@H]([C@H](C)O)O |
| InChIKey | QUADQLCGKXETIS-ZWKOTPCHSA-N |
Product Overview
Octadecane-2,3-diol (CAS 78709-62-3), with molecular formula C18H38O2 and molecular weight 286.29 g/mol. IUPAC: (2S,3R)-octadecane-2,3-diol.
Chemical Property Profile of Octadecane-2,3-diol
Property Insights of Octadecane-2,3-diol
The XLogP value of 7.1 indicates that Octadecane-2,3-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, Octadecane-2,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadecane-2,3-diol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octadecane-2,3-diol?
The CAS number of Octadecane-2,3-diol is 78709-62-3.
What is the molecular formula of Octadecane-2,3-diol?
The molecular formula of Octadecane-2,3-diol is C18H38O2.
What is the molecular weight of Octadecane-2,3-diol?
The molecular weight of Octadecane-2,3-diol is 286.29 g/mol.
Where can I buy Octadecane-2,3-diol?
You can request a quote for Octadecane-2,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecane-2,3-diol?
Yes, KEHONG BIO provides custom synthesis services for Octadecane-2,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.