RefChem:335395
TL;DR: RefChem:335395 (CAS 97720-36-0) is a chemical compound with molecular formula C14H24O3 and molecular weight 240.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyclohexyl-4-propan-2-yl-2,6,7-trioxabicyclo[2.2.2]octane
Also Known As: 1-Cyclohexyl-4-isopropylbicycloorthocarboxylate, 2,6,7-Trioxabicyclo(2.2.2)octane, 1-cyclohexyl-4-(1-methylethyl)-, Cyclohexaneorthocarboxylic acid, cyclic ester with 2-(hydroxymethyl)-2-isopropyl-1,3-propanediol, 4-cyclohexyl-1-propan-2-yl-3,5,8-trioxabicyclo[2.2.2]octane, 1-Cyclohexyl-4-(propan-2-yl)-2,6,7-trioxabicyclo[2.2.2]octane
| Molecular Formula | C14H24O3 |
|---|---|
| Molecular Weight | 240.17 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.17255 |
| Heavy Atoms | 17 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 97720-36-0 |
|---|---|
| SMILES | CC(C)C12COC(OC1)(OC2)C3CCCCC3 |
| InChIKey | XCIOJVMHHFNVEJ-UHFFFAOYSA-N |
Product Overview
RefChem:335395 (CAS 97720-36-0), with molecular formula C14H24O3 and molecular weight 240.17 g/mol. IUPAC: 1-cyclohexyl-4-propan-2-yl-2,6,7-trioxabicyclo[2.2.2]octane.
Chemical Property Profile of RefChem:335395
Property Insights of RefChem:335395
The XLogP value of 3.2 indicates that RefChem:335395 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, RefChem:335395 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:335395 has 0 hydrogen bond donor(s) and 3 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 RefChem:335395?
The CAS number of RefChem:335395 is 97720-36-0.
What is the molecular formula of RefChem:335395?
The molecular formula of RefChem:335395 is C14H24O3.
What is the molecular weight of RefChem:335395?
The molecular weight of RefChem:335395 is 240.17 g/mol.
Where can I buy RefChem:335395?
You can request a quote for RefChem:335395 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:335395?
Yes, KEHONG BIO provides custom synthesis services for RefChem:335395 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.