Dihydroterpinyl acetate
TL;DR: Dihydroterpinyl acetate (CAS 80-25-1) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylcyclohexyl)propan-2-yl acetate
Also Known As: Dihydroterpinyl acetate, p-Menthan-8-yl acetate, Menthanyl acetate, Menthyl acetate, Dihydroterpineol acetate
| Molecular Formula | C12H22O2 |
|---|---|
| Molecular Weight | 198.16 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.16199 |
| Heavy Atoms | 14 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 80-25-1 |
|---|---|
| SMILES | CC1CCC(CC1)C(C)(C)OC(=O)C |
| InChIKey | HBNHCGDYYBMKJN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dihydroterpinyl acetate (CAS 80-25-1), with molecular formula C12H22O2 and molecular weight 198.16 g/mol. IUPAC: 2-(4-methylcyclohexyl)propan-2-yl acetate.
Chemical Property Profile of Dihydroterpinyl acetate
Property Insights of Dihydroterpinyl acetate
The XLogP value of 3.4 indicates that Dihydroterpinyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Dihydroterpinyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydroterpinyl acetate has 0 hydrogen bond donor(s) and 2 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 Dihydroterpinyl acetate?
The CAS number of Dihydroterpinyl acetate is 80-25-1.
What is the molecular formula of Dihydroterpinyl acetate?
The molecular formula of Dihydroterpinyl acetate is C12H22O2.
What is the molecular weight of Dihydroterpinyl acetate?
The molecular weight of Dihydroterpinyl acetate is 198.16 g/mol.
Where can I buy Dihydroterpinyl acetate?
You can request a quote for Dihydroterpinyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydroterpinyl acetate?
Yes, KEHONG BIO provides custom synthesis services for Dihydroterpinyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.