4,6-Bis(1-methylpentyl)resorcinol
TL;DR: 4,6-Bis(1-methylpentyl)resorcinol (CAS 17048-38-3) is a chemical compound with molecular formula C18H30O2 and molecular weight 278.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-di(hexan-2-yl)benzene-1,3-diol
Also Known As: 4,6-di(hexan-2-yl)benzene-1,3-diol, 4,6-BIS(1-METHYLPENTYL)RESORCINOL, Resorcinol, 4,6-bis(1-methylpentyl)-, 4,6-DIHEXAN-2-YLBENZENE-1,3-DIOL, 1,3-Benzenediol, 4,6-bis(1-methylpentyl)-
| Molecular Formula | C18H30O2 |
|---|---|
| Molecular Weight | 278.22 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 278.22458 |
| Heavy Atoms | 20 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 17048-38-3 |
|---|---|
| SMILES | CCCCC(C)C1=CC(=C(C=C1O)O)C(C)CCCC |
| InChIKey | PJKFUVDARBUTMP-UHFFFAOYSA-N |
Product Overview
4,6-Bis(1-methylpentyl)resorcinol (CAS 17048-38-3), with molecular formula C18H30O2 and molecular weight 278.22 g/mol. IUPAC: 4,6-di(hexan-2-yl)benzene-1,3-diol.
Chemical Property Profile of 4,6-Bis(1-methylpentyl)resorcinol
Property Insights of 4,6-Bis(1-methylpentyl)resorcinol
The XLogP value of 6.7 indicates that 4,6-Bis(1-methylpentyl)resorcinol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 4,6-Bis(1-methylpentyl)resorcinol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Bis(1-methylpentyl)resorcinol 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 4,6-Bis(1-methylpentyl)resorcinol?
The CAS number of 4,6-Bis(1-methylpentyl)resorcinol is 17048-38-3.
What is the molecular formula of 4,6-Bis(1-methylpentyl)resorcinol?
The molecular formula of 4,6-Bis(1-methylpentyl)resorcinol is C18H30O2.
What is the molecular weight of 4,6-Bis(1-methylpentyl)resorcinol?
The molecular weight of 4,6-Bis(1-methylpentyl)resorcinol is 278.22 g/mol.
Where can I buy 4,6-Bis(1-methylpentyl)resorcinol?
You can request a quote for 4,6-Bis(1-methylpentyl)resorcinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Bis(1-methylpentyl)resorcinol?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Bis(1-methylpentyl)resorcinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.