2-(Piperidin-1-yl)benzoic acid
TL;DR: 2-(Piperidin-1-yl)benzoic acid (CAS 5845-30-7) 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.
2-piperidin-1-ylbenzoic acid
Also Known As: 2-(1-piperidinyl)Benzoic acid, 2-(piperidin-1-yl)benzoic acid, 2-piperidin-1-ylbenzoic acid, 2-piperidinobenzoic acid, 2-(1-piperidyl)benzoic Acid
| Molecular Formula | C12H15NO2 |
|---|---|
| Molecular Weight | 205.11 g/mol |
| LogP | 2.4 |
| 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 | 224.0 |
Chemical Identifiers
| CAS Number | 5845-30-7 |
|---|---|
| SMILES | C1CCN(CC1)C2=CC=CC=C2C(=O)O |
| InChIKey | TVEAZHOLMPKUGM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Piperidin-1-yl)benzoic acid (CAS 5845-30-7), with molecular formula C12H15NO2 and molecular weight 205.11 g/mol. IUPAC: 2-piperidin-1-ylbenzoic acid.
Chemical Property Profile of 2-(Piperidin-1-yl)benzoic acid
Property Insights of 2-(Piperidin-1-yl)benzoic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Piperidin-1-yl)benzoic acid. With a topological polar surface area (TPSA) of 40.5 Ų, 2-(Piperidin-1-yl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(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 2-(Piperidin-1-yl)benzoic acid?
The CAS number of 2-(Piperidin-1-yl)benzoic acid is 5845-30-7.
What is the molecular formula of 2-(Piperidin-1-yl)benzoic acid?
The molecular formula of 2-(Piperidin-1-yl)benzoic acid is C12H15NO2.
What is the molecular weight of 2-(Piperidin-1-yl)benzoic acid?
The molecular weight of 2-(Piperidin-1-yl)benzoic acid is 205.11 g/mol.
Where can I buy 2-(Piperidin-1-yl)benzoic acid?
You can request a quote for 2-(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 2-(Piperidin-1-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Piperidin-1-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.