Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1)
TL;DR: Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1) (CAS 38819-01-1) is a chemical compound with molecular formula C13H14N2O3 and molecular weight 246.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxybenzoic acid;pyridin-3-ylmethanamine
Also Known As: 3-(Aminomethyl)pyridyl salicylate, 3-pyridylmethylamine salicylate, PICOLAMINE SALICYLATE, 3-(aminomethyl)-pyridyl salicylate, 2-hydroxybenzoic acid;pyridin-3-ylmethanamine
| Molecular Formula | C13H14N2O3 |
|---|---|
| Molecular Weight | 246.10 g/mol |
| LogP | 1.6307 |
| Topological Polar Surface Area | 96.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.10045 |
| Heavy Atoms | 18 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 38819-01-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)O.C1=CC(=CN=C1)CN |
| InChIKey | FRLFYILRHPWIEA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1) (CAS 38819-01-1), with molecular formula C13H14N2O3 and molecular weight 246.10 g/mol. IUPAC: 2-hydroxybenzoic acid;pyridin-3-ylmethanamine.
Chemical Property Profile of Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1)
Property Insights of Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1)
The XLogP value of 1.6307 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1). The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1). Following Lipinski's Rule of Five, Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1) has 3 hydrogen bond donor(s) and 5 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 Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1)?
The CAS number of Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1) is 38819-01-1.
What is the molecular formula of Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1)?
The molecular formula of Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1) is C13H14N2O3.
What is the molecular weight of Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1)?
The molecular weight of Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1) is 246.10 g/mol.
Where can I buy Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1)?
You can request a quote for Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-hydroxy-, compd. with 3-pyridinemethanamine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.