5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid
TL;DR: 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid (CAS 896717-80-9) is a chemical compound with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-2-(oxolan-2-ylmethylamino)benzoic acid
Also Known As: 5-AMINO-2-[(TETRAHYDRO-2-FURANYLMETHYL)AMINO]BENZOIC ACID, 5-amino-2-(oxolan-2-ylmethylamino)benzoic acid, 5-Amino-2-(((tetrahydrofuran-2-yl)methyl)amino)benzoic acid, CHEMBRDG-BB 7601657, A4040/0172276
| Molecular Formula | C12H16N2O3 |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 1.5579 |
| Topological Polar Surface Area | 84.58 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.11609 |
| Heavy Atoms | 17 |
| Complexity | 414.21182 |
Chemical Identifiers
| CAS Number | 896717-80-9 |
|---|---|
| SMILES | C1CC(OC1)CNC2=C(C=C(C=C2)N)C(=O)O |
Product Overview
5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid (CAS 896717-80-9), with molecular formula C12H16N2O3 and molecular weight 236.12 g/mol. IUPAC: 5-amino-2-(oxolan-2-ylmethylamino)benzoic acid.
Chemical Property Profile of 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid
Property Insights of 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid
The XLogP value of 1.5579 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid. The TPSA of 84.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid. Following Lipinski's Rule of Five, 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid has 3 hydrogen bond donor(s) and 4 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 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid?
The CAS number of 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid is 896717-80-9.
What is the molecular formula of 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid?
The molecular formula of 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid is C12H16N2O3.
What is the molecular weight of 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid?
The molecular weight of 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid is 236.12 g/mol.
Where can I buy 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid?
You can request a quote for 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-2-(oxolan-2-ylmethylamino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.