2-Hexyl-1,3-benzenediol
TL;DR: 2-Hexyl-1,3-benzenediol (CAS 67089-07-0) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hexylbenzene-1,3-diol
Also Known As: 2-hexylbenzene-1,3-diol, 2-Hexyl-1,3-benzenediol, Hexylresorcin, Kopnol, hexyl resorcinol
| Molecular Formula | C12H18O2 |
|---|---|
| Molecular Weight | 194.13 g/mol |
| LogP | 3.2206 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 261.40027 |
Chemical Identifiers
| CAS Number | 67089-07-0 |
|---|---|
| SMILES | CCCCCCC1=C(C=CC=C1O)O |
Product Overview
2-Hexyl-1,3-benzenediol (CAS 67089-07-0), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: 2-hexylbenzene-1,3-diol.
Chemical Property Profile of 2-Hexyl-1,3-benzenediol
Property Insights of 2-Hexyl-1,3-benzenediol
The XLogP value of 3.2206 indicates that 2-Hexyl-1,3-benzenediol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, 2-Hexyl-1,3-benzenediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hexyl-1,3-benzenediol 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-Hexyl-1,3-benzenediol?
The CAS number of 2-Hexyl-1,3-benzenediol is 67089-07-0.
What is the molecular formula of 2-Hexyl-1,3-benzenediol?
The molecular formula of 2-Hexyl-1,3-benzenediol is C12H18O2.
What is the molecular weight of 2-Hexyl-1,3-benzenediol?
The molecular weight of 2-Hexyl-1,3-benzenediol is 194.13 g/mol.
Where can I buy 2-Hexyl-1,3-benzenediol?
You can request a quote for 2-Hexyl-1,3-benzenediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hexyl-1,3-benzenediol?
Yes, KEHONG BIO provides custom synthesis services for 2-Hexyl-1,3-benzenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.