3-(3-Carboxypropanamido)benzoic acid
TL;DR: 3-(3-Carboxypropanamido)benzoic acid (CAS 259222-20-3) is a chemical compound with molecular formula C11H11NO5 and molecular weight 237.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-carboxypropanoylamino)benzoic acid
Also Known As: 3-(3-carboxypropanamido)benzoic acid, IFLab1_001254, 3-(3-carboxypropanoylamino)benzoic acid, 3-[(3-carboxypropanoyl)amino]benzoic acid, 3-(3-Carboxy-propionylamino)-benzoic acid
| Molecular Formula | C11H11NO5 |
|---|---|
| Molecular Weight | 237.06 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 237.06372 |
| Heavy Atoms | 17 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 259222-20-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)CCC(=O)O)C(=O)O |
| InChIKey | IKRKGFIXYILHIJ-UHFFFAOYSA-N |
Product Overview
3-(3-Carboxypropanamido)benzoic acid (CAS 259222-20-3), with molecular formula C11H11NO5 and molecular weight 237.06 g/mol. IUPAC: 3-(3-carboxypropanoylamino)benzoic acid.
Chemical Property Profile of 3-(3-Carboxypropanamido)benzoic acid
Property Insights of 3-(3-Carboxypropanamido)benzoic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Carboxypropanamido)benzoic acid. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-Carboxypropanamido)benzoic acid. Following Lipinski's Rule of Five, 3-(3-Carboxypropanamido)benzoic acid 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 3-(3-Carboxypropanamido)benzoic acid?
The CAS number of 3-(3-Carboxypropanamido)benzoic acid is 259222-20-3.
What is the molecular formula of 3-(3-Carboxypropanamido)benzoic acid?
The molecular formula of 3-(3-Carboxypropanamido)benzoic acid is C11H11NO5.
What is the molecular weight of 3-(3-Carboxypropanamido)benzoic acid?
The molecular weight of 3-(3-Carboxypropanamido)benzoic acid is 237.06 g/mol.
Where can I buy 3-(3-Carboxypropanamido)benzoic acid?
You can request a quote for 3-(3-Carboxypropanamido)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Carboxypropanamido)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Carboxypropanamido)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.