4-Methylphenyl 2-aminobenzoate
TL;DR: 4-Methylphenyl 2-aminobenzoate (CAS 100669-98-5) is a chemical compound with molecular formula C14H13NO2 and molecular weight 227.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methylphenyl) 2-aminobenzoate
Also Known As: 4-methylphenyl 2-aminobenzoate, p-tolyl 2-aminobenzoate, 4-Methylphenyl anthranilate, (4-methylphenyl) 2-aminobenzoate, 4-methylphenyl anthranylate
Technical Specifications
| Molecular Formula | C14H13NO2 |
| Molecular Weight | 227.09464 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.09464 Da |
| Heavy Atoms | 17 |
| Complexity | 259.0 |
| SMILES | CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2N |
| InChIKey | FEGACFSRBYNYKS-UHFFFAOYSA-N |
Chemical Property Profile of 4-Methylphenyl 2-aminobenzoate
Property Insights of 4-Methylphenyl 2-aminobenzoate
The XLogP value of 3.7 indicates that 4-Methylphenyl 2-aminobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, 4-Methylphenyl 2-aminobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylphenyl 2-aminobenzoate has 1 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-Methylphenyl 2-aminobenzoate?
The CAS number of 4-Methylphenyl 2-aminobenzoate is 100669-98-5.
What is the molecular formula of 4-Methylphenyl 2-aminobenzoate?
The molecular formula of 4-Methylphenyl 2-aminobenzoate is C14H13NO2.
What is the molecular weight of 4-Methylphenyl 2-aminobenzoate?
The molecular weight of 4-Methylphenyl 2-aminobenzoate is 227.09464 g/mol.
Where can I buy 4-Methylphenyl 2-aminobenzoate?
You can request a quote for 4-Methylphenyl 2-aminobenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methylphenyl 2-aminobenzoate?
Yes, CoreyChem provides custom synthesis services for 4-Methylphenyl 2-aminobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.