![Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester structure](/static/products/895/89573-91-1.png)
Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester
TL;DR: Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester (CAS 89573-91-1) is a chemical compound with molecular formula C18H27NO3 and molecular weight 305.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(hexanoylamino)phenyl] hexanoate
Also Known As: 4-(Hexanoylamino)phenyl hexanoate, 4-HEXANAMIDOPHENYL HEXANOATE, [4-(hexanoylamino)phenyl] hexanoate, 4-(Hexanoylamino)phenyl hexanoate #, Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester
| Molecular Formula | C18H27NO3 |
|---|---|
| Molecular Weight | 305.20 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 305.1991 |
| Heavy Atoms | 22 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 89573-91-1 |
|---|---|
| SMILES | CCCCCC(=O)NC1=CC=C(C=C1)OC(=O)CCCCC |
| InChIKey | ZIPJSDIMPDGGMS-UHFFFAOYSA-N |
Product Overview
Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester (CAS 89573-91-1), with molecular formula C18H27NO3 and molecular weight 305.20 g/mol. IUPAC: [4-(hexanoylamino)phenyl] hexanoate.
Chemical Property Profile of Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester
Property Insights of Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester
The XLogP value of 4.7 indicates that Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester has 1 hydrogen bond donor(s) and 3 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 Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester?
The CAS number of Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester is 89573-91-1.
What is the molecular formula of Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester?
The molecular formula of Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester is C18H27NO3.
What is the molecular weight of Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester?
The molecular weight of Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester is 305.20 g/mol.
Where can I buy Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester?
You can request a quote for Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hexanoic acid, 4-[(1-oxohexyl)amino]phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.