Polygodial
TL;DR: Polygodial (CAS 33118-34-2) is a chemical compound with molecular formula C15H22O2 and molecular weight 234.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,4aR,8aR)-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalene-1,2-dicarbaldehyde
Also Known As: Polygodial, Polygodial, (+/-)-, KST-1A3969, (1s,4ar,8ar)-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalene-1,2-dicarbaldehyde, (1S,4aR,8aR)-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalene-1,2-dicarbaldehyde
| Molecular Formula | C15H22O2 |
|---|---|
| Molecular Weight | 234.16 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.16199 |
| Heavy Atoms | 17 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 33118-34-2 |
|---|---|
| SMILES | C[C@@]12CCCC([C@H]1CC=C([C@H]2C=O)C=O)(C)C |
| InChIKey | AZJUJOFIHHNCSV-NFAWXSAZSA-N |
Product Overview
Polygodial (CAS 33118-34-2), with molecular formula C15H22O2 and molecular weight 234.16 g/mol. IUPAC: (1S,4aR,8aR)-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalene-1,2-dicarbaldehyde.
Chemical Property Profile of Polygodial
Property Insights of Polygodial
The XLogP value of 3.2 indicates that Polygodial is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, Polygodial exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Polygodial 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 Polygodial?
The CAS number of Polygodial is 33118-34-2.
What is the molecular formula of Polygodial?
The molecular formula of Polygodial is C15H22O2.
What is the molecular weight of Polygodial?
The molecular weight of Polygodial is 234.16 g/mol.
Where can I buy Polygodial?
You can request a quote for Polygodial directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Polygodial?
Yes, KEHONG BIO provides custom synthesis services for Polygodial and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.