2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol
TL;DR: 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol (CAS 72207-58-0) is a chemical compound with molecular formula C30H54O2 and molecular weight 446.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol
Also Known As: 1,4-Benzenediol, 2,?-didodecyl-, branched, 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol
| Molecular Formula | C30H54O2 |
|---|---|
| Molecular Weight | 446.41 g/mol |
| LogP | 9.7364 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 20 |
| Exact Mass | 446.41238 |
| Heavy Atoms | 32 |
| Complexity | 528.68945 |
Chemical Identifiers
| CAS Number | 72207-58-0 |
|---|---|
| SMILES | CCCCC[C@@H](CCCC)CCC1=CC(=C(C=C1O)CC[C@H](CCCC)CCCCC)O |
Product Overview
2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol (CAS 72207-58-0), with molecular formula C30H54O2 and molecular weight 446.41 g/mol. IUPAC: 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol.
Chemical Property Profile of 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol
Property Insights of 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol
The XLogP value of 9.7364 indicates that 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-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 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol?
The CAS number of 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol is 72207-58-0.
What is the molecular formula of 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol?
The molecular formula of 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol is C30H54O2.
What is the molecular weight of 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol?
The molecular weight of 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol is 446.41 g/mol.
Where can I buy 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol?
You can request a quote for 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 2,5-bis[(3R)-3-butyloctyl]benzene-1,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.