4-(Piperidin-1-yl)benzoic acid
TL;DR: 4-(Piperidin-1-yl)benzoic acid (CAS 72768-95-7) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-piperidin-1-ylbenzoic acid
Also Known As: 4-(piperidin-1-yl)benzoic acid, 4-Piperidin-1-yl-benzoic acid, 4-piperidinobenzoic acid, 4-piperidin-1-ylbenzoic acid, 4-piperidylbenzoic acid
| Molecular Formula | C12H15NO2 |
|---|---|
| Molecular Weight | 205.11 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.11028 |
| Heavy Atoms | 15 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 72768-95-7 |
|---|---|
| SMILES | C1CCN(CC1)C2=CC=C(C=C2)C(=O)O |
| InChIKey | DGJNUESQBVPXAY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Piperidin-1-yl)benzoic acid (CAS 72768-95-7), with molecular formula C12H15NO2 and molecular weight 205.11 g/mol. IUPAC: 4-piperidin-1-ylbenzoic acid.
Chemical Property Profile of 4-(Piperidin-1-yl)benzoic acid
Property Insights of 4-(Piperidin-1-yl)benzoic acid
The XLogP value of 3.0 indicates that 4-(Piperidin-1-yl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 4-(Piperidin-1-yl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Piperidin-1-yl)benzoic 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 4-(Piperidin-1-yl)benzoic acid?
The CAS number of 4-(Piperidin-1-yl)benzoic acid is 72768-95-7.
What is the molecular formula of 4-(Piperidin-1-yl)benzoic acid?
The molecular formula of 4-(Piperidin-1-yl)benzoic acid is C12H15NO2.
What is the molecular weight of 4-(Piperidin-1-yl)benzoic acid?
The molecular weight of 4-(Piperidin-1-yl)benzoic acid is 205.11 g/mol.
Where can I buy 4-(Piperidin-1-yl)benzoic acid?
You can request a quote for 4-(Piperidin-1-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Piperidin-1-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(Piperidin-1-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.