2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy-
TL;DR: 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy- (CAS 107811-51-8) is a chemical compound with molecular formula C14H20O3 and molecular weight 236.14125 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-heptyl-6-methoxycyclohexa-2,5-diene-1,4-dione
Also Known As: 2-Heptyl-6-methoxy-1,4-benzoquinone, 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy-, 2-Heptyl-6-methoxy-2,5-cyclohexadiene-1,4-dione, 2-heptyl-6-methoxycyclohexa-2,5-diene-1,4-dione, J1.486.779A
Technical Specifications
| Molecular Formula | C14H20O3 |
| Molecular Weight | 236.14125 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 236.14125 Da |
| Heavy Atoms | 17 |
| Complexity | 350.0 |
| SMILES | CCCCCCCC1=CC(=O)C=C(C1=O)OC |
| InChIKey | FVLYRFSEEUSOAL-UHFFFAOYSA-N |
Chemical Property Profile of 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy-
Property Insights of 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy-
The XLogP value of 3.7 indicates that 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy- 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
What is the CAS number of 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy-?
The CAS number of 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy- is 107811-51-8.
What is the molecular formula of 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy-?
The molecular formula of 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy- is C14H20O3.
What is the molecular weight of 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy-?
The molecular weight of 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy- is 236.14125 g/mol.
Where can I buy 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy-?
You can request a quote for 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy-?
Yes, CoreyChem provides custom synthesis services for 2,5-Cyclohexadiene-1,4-dione, 2-heptyl-6-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.