3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal
TL;DR: 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal (CAS 20519-71-5) is a chemical compound with molecular formula C18H30O4 and molecular weight 310.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-bis(4-hydroxycyclohexyl)-2-oxohexanal
Also Known As: Perhydrodiketohexestrol
| Molecular Formula | C18H30O4 |
|---|---|
| Molecular Weight | 310.21 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 310.21442 |
| Heavy Atoms | 22 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 20519-71-5 |
|---|---|
| SMILES | CCC(C1CCC(CC1)O)C(C2CCC(CC2)O)C(=O)C=O |
| InChIKey | WMNZCQYFRFPBAZ-UHFFFAOYSA-N |
Product Overview
3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal (CAS 20519-71-5), with molecular formula C18H30O4 and molecular weight 310.21 g/mol. IUPAC: 3,4-bis(4-hydroxycyclohexyl)-2-oxohexanal.
Chemical Property Profile of 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal
Property Insights of 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal. Following Lipinski's Rule of Five, 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal has 2 hydrogen bond donor(s) and 4 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 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal?
The CAS number of 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal is 20519-71-5.
What is the molecular formula of 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal?
The molecular formula of 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal is C18H30O4.
What is the molecular weight of 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal?
The molecular weight of 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal is 310.21 g/mol.
Where can I buy 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal?
You can request a quote for 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Bis(4-hydroxycyclohexyl)-2-oxohexanal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.