Methyl(4-piperidinophenyl)acetic acid
TL;DR: Methyl(4-piperidinophenyl)acetic acid (CAS 5468-18-8) is a chemical compound with molecular formula C14H19NO2 and molecular weight 233.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-piperidin-1-ylphenyl)propanoic acid
Also Known As: Methyl(4-piperidinophenyl)acetic acid, 2-(4-Piperidinophenyl)propionic acid, Propionic acid, 2-(4-piperidinophenyl)-, 2-[4-(piperidin-1-yl)phenyl]propanoic acid, 2-(4-piperidin-1-ylphenyl)propanoic acid
| Molecular Formula | C14H19NO2 |
|---|---|
| Molecular Weight | 233.14 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.14159 |
| Heavy Atoms | 17 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 5468-18-8 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)N2CCCCC2)C(=O)O |
| InChIKey | BMIWGVXKTLCCEV-UHFFFAOYSA-N |
Product Overview
Methyl(4-piperidinophenyl)acetic acid (CAS 5468-18-8), with molecular formula C14H19NO2 and molecular weight 233.14 g/mol. IUPAC: 2-(4-piperidin-1-ylphenyl)propanoic acid.
Chemical Property Profile of Methyl(4-piperidinophenyl)acetic acid
Property Insights of Methyl(4-piperidinophenyl)acetic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl(4-piperidinophenyl)acetic acid. With a topological polar surface area (TPSA) of 40.5 Ų, Methyl(4-piperidinophenyl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl(4-piperidinophenyl)acetic acid 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 Methyl(4-piperidinophenyl)acetic acid?
The CAS number of Methyl(4-piperidinophenyl)acetic acid is 5468-18-8.
What is the molecular formula of Methyl(4-piperidinophenyl)acetic acid?
The molecular formula of Methyl(4-piperidinophenyl)acetic acid is C14H19NO2.
What is the molecular weight of Methyl(4-piperidinophenyl)acetic acid?
The molecular weight of Methyl(4-piperidinophenyl)acetic acid is 233.14 g/mol.
Where can I buy Methyl(4-piperidinophenyl)acetic acid?
You can request a quote for Methyl(4-piperidinophenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl(4-piperidinophenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for Methyl(4-piperidinophenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.