6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester
TL;DR: 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester (CAS 883841-71-2) is a chemical compound with molecular formula C25H32O4 and molecular weight 396.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-[[4-(6-methoxy-6-oxohexyl)phenyl]methyl]phenyl]pentanoic acid
Also Known As: 5-(4-(4-(6-Methoxy-6-oxohexyl)benzyl)phenyl)pentanoic acid, 5-[4-[[4-(6-methoxy-6-oxohexyl)phenyl]methyl]phenyl]pentanoic acid, 5-[4-[[4-(5-methoxycarbonylpentyl)phenyl]methyl]phenyl]pentanoic Acid, 6-(4-(4-(4-CARBOXY-BUTYL)-BENZYL)-PHENYL)-HEXANOIC ACID METHYL ESTER
| Molecular Formula | C25H32O4 |
|---|---|
| Molecular Weight | 396.23 g/mol |
| LogP | 5.3507 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 396.23007 |
| Heavy Atoms | 29 |
| Complexity | 747.39777 |
Chemical Identifiers
| CAS Number | 883841-71-2 |
|---|---|
| SMILES | COC(=O)CCCCCC1=CC=C(C=C1)CC2=CC=C(C=C2)CCCCC(=O)O |
Product Overview
6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester (CAS 883841-71-2), with molecular formula C25H32O4 and molecular weight 396.23 g/mol. IUPAC: 5-[4-[[4-(6-methoxy-6-oxohexyl)phenyl]methyl]phenyl]pentanoic acid.
Chemical Property Profile of 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester
Property Insights of 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester
The XLogP value of 5.3507 indicates that 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester. Following Lipinski's Rule of Five, 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester has 1 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 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester?
The CAS number of 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester is 883841-71-2.
What is the molecular formula of 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester?
The molecular formula of 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester is C25H32O4.
What is the molecular weight of 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester?
The molecular weight of 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester is 396.23 g/mol.
Where can I buy 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester?
You can request a quote for 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 6-(4-(4-(4-Carboxy-butyl)-benzyl)-phenyl)-hexanoic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.