Isomintlactone
TL;DR: Isomintlactone (CAS 75684-66-1) is a chemical compound with molecular formula C10H14O2 and molecular weight 166.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7aS)-3,6-dimethyl-5,6,7,7a-tetrahydro-4H-1-benzofuran-2-one
Also Known As: Isomintlactone, Menthalactone, (+)-Isomintlactone, (+/-)-Isomintlactone, 2(4H)-benzofuranone, 5,6,7,7a-tetrahydro-3,6-dimethyl-, (6R,7aS)-
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 75684-66-1 |
|---|---|
| SMILES | C[C@@H]1CCC2=C(C(=O)O[C@H]2C1)C |
| InChIKey | VUVQBYIJRDUVHT-MUWHJKNJSA-N |
Product Overview
Isomintlactone (CAS 75684-66-1), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: (6R,7aS)-3,6-dimethyl-5,6,7,7a-tetrahydro-4H-1-benzofuran-2-one.
Chemical Property Profile of Isomintlactone
Property Insights of Isomintlactone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isomintlactone. With a topological polar surface area (TPSA) of 26.3 Ų, Isomintlactone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isomintlactone 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 Isomintlactone?
The CAS number of Isomintlactone is 75684-66-1.
What is the molecular formula of Isomintlactone?
The molecular formula of Isomintlactone is C10H14O2.
What is the molecular weight of Isomintlactone?
The molecular weight of Isomintlactone is 166.10 g/mol.
Where can I buy Isomintlactone?
You can request a quote for Isomintlactone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isomintlactone?
Yes, KEHONG BIO provides custom synthesis services for Isomintlactone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.