3-n-Boc-3-(4-hexyloxyphenyl)propionic acid
TL;DR: 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid (CAS 728919-71-9) is a chemical compound with molecular formula C20H31NO5 and molecular weight 365.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-hexoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: Not Available, 3-n-boc-3-(4-hexyloxyphenyl)propionic acid, 3-(4-hexoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic Acid
| Molecular Formula | C20H31NO5 |
|---|---|
| Molecular Weight | 365.22 g/mol |
| LogP | 4.6862 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 365.2202 |
| Heavy Atoms | 26 |
| Complexity | 562.55945 |
Chemical Identifiers
| CAS Number | 728919-71-9 |
|---|---|
| SMILES | CCCCCCOC1=CC=C(C=C1)C(CC(=O)O)NC(=O)OC(C)(C)C |
Product Overview
3-n-Boc-3-(4-hexyloxyphenyl)propionic acid (CAS 728919-71-9), with molecular formula C20H31NO5 and molecular weight 365.22 g/mol. IUPAC: 3-(4-hexoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid.
Chemical Property Profile of 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid
Property Insights of 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid
The XLogP value of 4.6862 indicates that 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid. Following Lipinski's Rule of Five, 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid has 2 hydrogen bond donor(s) and 4 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-n-Boc-3-(4-hexyloxyphenyl)propionic acid?
The CAS number of 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid is 728919-71-9.
What is the molecular formula of 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid?
The molecular formula of 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid is C20H31NO5.
What is the molecular weight of 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid?
The molecular weight of 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid is 365.22 g/mol.
Where can I buy 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid?
You can request a quote for 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-n-Boc-3-(4-hexyloxyphenyl)propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.