Isogyorinidal
TL;DR: Isogyorinidal (CAS 55806-39-8) is a chemical compound with molecular formula C14H18O3 and molecular weight 234.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,6E,9Z)-3,7-dimethyl-8,11-dioxododeca-2,6,9-trienal
Also Known As: Isogyorinidal, Gyrinidal, 1-(2-Hydroxy-5-nitro-phenyl)-propan-1-on, (2E,6E,9Z)-3,7-dimethyl-8,11-dioxododeca-2,6,9-trienal, (e,e,z)-3,7-dimethyl-8,11-dioxo-2,6,9-dodecatrienal
| Molecular Formula | C14H18O3 |
|---|---|
| Molecular Weight | 234.13 g/mol |
| LogP | 2.5724 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 234.1256 |
| Heavy Atoms | 17 |
| Complexity | 384.2715 |
Chemical Identifiers
| CAS Number | 55806-39-8 |
|---|---|
| SMILES | C/C(=C\C=O)/CC/C=C(\C)/C(=O)/C=C\C(=O)C |
Product Overview
Isogyorinidal (CAS 55806-39-8), with molecular formula C14H18O3 and molecular weight 234.13 g/mol. IUPAC: (2E,6E,9Z)-3,7-dimethyl-8,11-dioxododeca-2,6,9-trienal.
Chemical Property Profile of Isogyorinidal
Property Insights of Isogyorinidal
The XLogP value of 2.5724 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isogyorinidal. With a topological polar surface area (TPSA) of 51.21 Ų, Isogyorinidal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isogyorinidal has 0 hydrogen bond donor(s) and 3 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 Isogyorinidal?
The CAS number of Isogyorinidal is 55806-39-8.
What is the molecular formula of Isogyorinidal?
The molecular formula of Isogyorinidal is C14H18O3.
What is the molecular weight of Isogyorinidal?
The molecular weight of Isogyorinidal is 234.13 g/mol.
Where can I buy Isogyorinidal?
You can request a quote for Isogyorinidal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isogyorinidal?
Yes, KEHONG BIO provides custom synthesis services for Isogyorinidal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.