4-(Propylamino)benzoic acid
TL;DR: 4-(Propylamino)benzoic acid (CAS 73686-77-8) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(propylamino)benzoic acid
Also Known As: 4-(propylamino)benzoic acid, 4-Propylaminobenzoesaeure, 4-propylaminobenzoic Acid, 4-(propylamino)benzoicacid, J3.123.179E
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 2.2067 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 279.48114 |
Chemical Identifiers
| CAS Number | 73686-77-8 |
|---|---|
| SMILES | CCCNC1=CC=C(C=C1)C(=O)O |
Product Overview
4-(Propylamino)benzoic acid (CAS 73686-77-8), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: 4-(propylamino)benzoic acid.
Chemical Property Profile of 4-(Propylamino)benzoic acid
Property Insights of 4-(Propylamino)benzoic acid
The XLogP value of 2.2067 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Propylamino)benzoic acid. With a topological polar surface area (TPSA) of 49.33 Ų, 4-(Propylamino)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Propylamino)benzoic acid has 2 hydrogen bond donor(s) and 2 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-(Propylamino)benzoic acid?
The CAS number of 4-(Propylamino)benzoic acid is 73686-77-8.
What is the molecular formula of 4-(Propylamino)benzoic acid?
The molecular formula of 4-(Propylamino)benzoic acid is C10H13NO2.
What is the molecular weight of 4-(Propylamino)benzoic acid?
The molecular weight of 4-(Propylamino)benzoic acid is 179.09 g/mol.
Where can I buy 4-(Propylamino)benzoic acid?
You can request a quote for 4-(Propylamino)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-(Propylamino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(Propylamino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.