5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one
TL;DR: 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one (CAS 61366-84-5) is a chemical compound with molecular formula C13H20O4 and molecular weight 240.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1-hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one
Also Known As: 5-(1-hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one, 5-(1-hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3
| Molecular Formula | C13H20O4 |
|---|---|
| Molecular Weight | 240.14 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.13615 |
| Heavy Atoms | 17 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 61366-84-5 |
|---|---|
| SMILES | CC1=CC(CCC1)(C2(C(=O)OC(O2)(C)C)C)O |
| InChIKey | SQKWRDWQDJXHMK-UHFFFAOYSA-N |
Product Overview
5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one (CAS 61366-84-5), with molecular formula C13H20O4 and molecular weight 240.14 g/mol. IUPAC: 5-(1-hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one.
Chemical Property Profile of 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one
Property Insights of 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one. With a topological polar surface area (TPSA) of 55.8 Ų, 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one has 1 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 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one?
The CAS number of 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one is 61366-84-5.
What is the molecular formula of 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one?
The molecular formula of 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one is C13H20O4.
What is the molecular weight of 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one?
The molecular weight of 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one is 240.14 g/mol.
Where can I buy 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one?
You can request a quote for 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(1-Hydroxy-3-methylcyclohex-2-en-1-yl)-2,2,5-trimethyl-1,3-dioxolan-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.