2-Amino-3-(propan-2-yl)benzoic acid
TL;DR: 2-Amino-3-(propan-2-yl)benzoic acid (CAS 154551-48-1) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-3-propan-2-ylbenzoic acid
Also Known As: 2-amino-3-(propan-2-yl)benzoic acid, 2-AMINO-3-ISOPROPYLBENZOIC ACID, 2-amino-3-propan-2-ylbenzoic acid, 2-amino-3-isopropyl-benzoic acid, 2-AMINO-3-ISOPROPYLBENZOICACID
Technical Specifications
| Molecular Formula | C10H13NO2 |
| Molecular Weight | 179.09464 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 179.09464 Da |
| Heavy Atoms | 13 |
| Complexity | 191.0 |
| SMILES | CC(C)C1=C(C(=CC=C1)C(=O)O)N |
| InChIKey | VSDBREZLAHYQJY-UHFFFAOYSA-N |
Chemical Property Profile of 2-Amino-3-(propan-2-yl)benzoic acid
Property Insights of 2-Amino-3-(propan-2-yl)benzoic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-3-(propan-2-yl)benzoic acid. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-3-(propan-2-yl)benzoic acid. Following Lipinski's Rule of Five, 2-Amino-3-(propan-2-yl)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 2-Amino-3-(propan-2-yl)benzoic acid?
The CAS number of 2-Amino-3-(propan-2-yl)benzoic acid is 154551-48-1.
What is the molecular formula of 2-Amino-3-(propan-2-yl)benzoic acid?
The molecular formula of 2-Amino-3-(propan-2-yl)benzoic acid is C10H13NO2.
What is the molecular weight of 2-Amino-3-(propan-2-yl)benzoic acid?
The molecular weight of 2-Amino-3-(propan-2-yl)benzoic acid is 179.09464 g/mol.
Where can I buy 2-Amino-3-(propan-2-yl)benzoic acid?
You can request a quote for 2-Amino-3-(propan-2-yl)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Amino-3-(propan-2-yl)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 2-Amino-3-(propan-2-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.