3,6-Octadienal, 3,7-dimethyl-
TL;DR: 3,6-Octadienal, 3,7-dimethyl- (CAS 55722-59-3) is a chemical compound with molecular formula C10H16O and molecular weight 152.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dimethylocta-3,6-dienal
Also Known As: Isocitral, Isogeranial, 3,7-Dimethyl-3,6-octadienal, 3,7-dimethylocta-3,6-dienal, 3,6-Octadienal, 3,7-dimethyl-
| Molecular Formula | C10H16O |
|---|---|
| Molecular Weight | 152.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 152.12012 |
| Heavy Atoms | 11 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 55722-59-3 |
|---|---|
| SMILES | CC(=CCC=C(C)CC=O)C |
| InChIKey | OJLMARCQPSGYNE-UHFFFAOYSA-N |
Product Overview
3,6-Octadienal, 3,7-dimethyl- (CAS 55722-59-3), with molecular formula C10H16O and molecular weight 152.12 g/mol. IUPAC: 3,7-dimethylocta-3,6-dienal.
Chemical Property Profile of 3,6-Octadienal, 3,7-dimethyl-
Property Insights of 3,6-Octadienal, 3,7-dimethyl-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,6-Octadienal, 3,7-dimethyl-. With a topological polar surface area (TPSA) of 17.1 Ų, 3,6-Octadienal, 3,7-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Octadienal, 3,7-dimethyl- has 0 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 3,6-Octadienal, 3,7-dimethyl-?
The CAS number of 3,6-Octadienal, 3,7-dimethyl- is 55722-59-3.
What is the molecular formula of 3,6-Octadienal, 3,7-dimethyl-?
The molecular formula of 3,6-Octadienal, 3,7-dimethyl- is C10H16O.
What is the molecular weight of 3,6-Octadienal, 3,7-dimethyl-?
The molecular weight of 3,6-Octadienal, 3,7-dimethyl- is 152.12 g/mol.
Where can I buy 3,6-Octadienal, 3,7-dimethyl-?
You can request a quote for 3,6-Octadienal, 3,7-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Octadienal, 3,7-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Octadienal, 3,7-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.