4-(Cyclopropylamino)-benzoic acid
TL;DR: 4-(Cyclopropylamino)-benzoic acid (CAS 1026042-46-5) is a chemical compound with molecular formula C10H11NO2 and molecular weight 177.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(cyclopropylamino)benzoic acid
Also Known As: 4-(cyclopropylamino)-benzoic acid, 4-(cyclopropylamino)benzoic Acid, Benzoic acid, 4-(cyclopropylamino)-
Technical Specifications
| Molecular Formula | C10H11NO2 |
| Molecular Weight | 177.07898 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 177.07898 Da |
| Heavy Atoms | 13 |
| Complexity | 193.0 |
| SMILES | C1CC1NC2=CC=C(C=C2)C(=O)O |
| InChIKey | NLCFKMIPCXOGNY-UHFFFAOYSA-N |
Chemical Property Profile of 4-(Cyclopropylamino)-benzoic acid
Property Insights of 4-(Cyclopropylamino)-benzoic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Cyclopropylamino)-benzoic acid. With a topological polar surface area (TPSA) of 49.3 Ų, 4-(Cyclopropylamino)-benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Cyclopropylamino)-benzoic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(Cyclopropylamino)-benzoic acid?
The CAS number of 4-(Cyclopropylamino)-benzoic acid is 1026042-46-5.
What is the molecular formula of 4-(Cyclopropylamino)-benzoic acid?
The molecular formula of 4-(Cyclopropylamino)-benzoic acid is C10H11NO2.
What is the molecular weight of 4-(Cyclopropylamino)-benzoic acid?
The molecular weight of 4-(Cyclopropylamino)-benzoic acid is 177.07898 g/mol.
Where can I buy 4-(Cyclopropylamino)-benzoic acid?
You can request a quote for 4-(Cyclopropylamino)-benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(Cyclopropylamino)-benzoic acid?
Yes, CoreyChem provides custom synthesis services for 4-(Cyclopropylamino)-benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.