![4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate structure](/static/products/1232/123286-51-1.webp)
4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate
TL;DR: 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate (CAS 123286-51-1) is a chemical compound with molecular formula C36H46O5 and molecular weight 558.33453 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-octan-2-yloxycarbonylphenyl) 4-(4-octoxyphenyl)benzoate
Also Known As: MHPOBC, Octan-2-yl 4-[4-(4-octoxyphenyl)benzoyl]oxybenzoate, (4-octan-2-yloxycarbonylphenyl) 4-(4-octoxyphenyl)benzoate, [4-(1-methylheptoxycarbonyl)phenyl] 4-(4-octoxyphenyl)benzoate, [4-[(2R)-octan-2-yl]oxycarbonylphenyl] 4-(4-octoxyphenyl)benzoate
Technical Specifications
| Molecular Formula | C36H46O5 |
| Molecular Weight | 558.33453 g/mol |
| XLogP | 11.5 |
| Topological Polar Surface Area (TPSA) | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 20 |
| Exact Mass | 558.33453 Da |
| Heavy Atoms | 41 |
| Complexity | 699.0 |
| SMILES | CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC(C)CCCCCC |
| InChIKey | AYYWUKWHSHVSLJ-UHFFFAOYSA-N |
Chemical Property Profile of 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate
Property Insights of 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate
The XLogP value of 11.5 indicates that 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate. Following Lipinski's Rule of Five, 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate?
The CAS number of 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate is 123286-51-1.
What is the molecular formula of 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate?
The molecular formula of 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate is C36H46O5.
What is the molecular weight of 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate?
The molecular weight of 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate is 558.33453 g/mol.
Where can I buy 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate?
You can request a quote for 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate?
Yes, CoreyChem provides custom synthesis services for 4-[((1R)-1-methylheptyl)oxycarbonyl]phenyl 4-(4-octyloxyphenyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.