Dihydro-beta-ionol
TL;DR: Dihydro-beta-ionol (CAS 99799-10-7) is a chemical compound with molecular formula C13H24O and molecular weight 196.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-ol
Also Known As: Dihydro-beta-ionol, Dihydro-b-ionol, FEMA No. 3627, dihydro-I+/--ionol, Dihydro- beta -ionol
| Molecular Formula | C13H24O |
|---|---|
| Molecular Weight | 196.18 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.18271 |
| Heavy Atoms | 14 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 99799-10-7 |
|---|---|
| SMILES | CC1=C(C(CCC1)(C)C)CCC(C)O |
| InChIKey | VSYLEWGIVLSDIY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dihydro-beta-ionol (CAS 99799-10-7), with molecular formula C13H24O and molecular weight 196.18 g/mol. IUPAC: 4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-ol.
Chemical Property Profile of Dihydro-beta-ionol
Property Insights of Dihydro-beta-ionol
The XLogP value of 3.2 indicates that Dihydro-beta-ionol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Dihydro-beta-ionol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydro-beta-ionol has 1 hydrogen bond donor(s) and 1 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 Dihydro-beta-ionol?
The CAS number of Dihydro-beta-ionol is 99799-10-7.
What is the molecular formula of Dihydro-beta-ionol?
The molecular formula of Dihydro-beta-ionol is C13H24O.
What is the molecular weight of Dihydro-beta-ionol?
The molecular weight of Dihydro-beta-ionol is 196.18 g/mol.
Where can I buy Dihydro-beta-ionol?
You can request a quote for Dihydro-beta-ionol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydro-beta-ionol?
Yes, KEHONG BIO provides custom synthesis services for Dihydro-beta-ionol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.