![(4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate structure](/static/products/813/81367-71-7.png)
(4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate
TL;DR: (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate (CAS 81367-71-7) is a chemical compound with molecular formula C30H36O3 and molecular weight 444.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate
Also Known As: (1,1'-Biphenyl)-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-(hexyloxy)phenyl ester, (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate, [1,1'-Biphenyl]-4-carboxylic acid, 4'-(2-methylbutyl)-, 4-(hexyloxy)phenyl ester
| Molecular Formula | C30H36O3 |
|---|---|
| Molecular Weight | 444.27 g/mol |
| LogP | 8.4355 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 444.26645 |
| Heavy Atoms | 33 |
| Complexity | 972.5601 |
Chemical Identifiers
| CAS Number | 81367-71-7 |
|---|---|
| SMILES | CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)[C@H](C)CCC |
Product Overview
(4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate (CAS 81367-71-7), with molecular formula C30H36O3 and molecular weight 444.27 g/mol. IUPAC: (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate.
Chemical Property Profile of (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate
Property Insights of (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate
The XLogP value of 8.4355 indicates that (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate?
The CAS number of (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate is 81367-71-7.
What is the molecular formula of (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate?
The molecular formula of (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate is C30H36O3.
What is the molecular weight of (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate?
The molecular weight of (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate is 444.27 g/mol.
Where can I buy (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate?
You can request a quote for (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for (4-hexoxyphenyl) 4-[4-[(2R)-pentan-2-yl]phenyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.