2-(4-Bromoanilino)benzoic acid
TL;DR: 2-(4-Bromoanilino)benzoic acid (CAS 13305-94-7) is a chemical compound with molecular formula C13H10BrNO2 and molecular weight 290.9895 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-bromoanilino)benzoic acid
Also Known As: 2-(4-Bromoanilino)benzoic acid, 2-[(4-bromophenyl)amino]benzoic acid, N-(4-BROMOPHENYL)ANTHRANILIC ACID, 2-(4-Bromo-phenylamino)-benzoic acid, 2-(4-Bromoanilino)benzoic acid #
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H10BrNO2 |
| Molecular Weight | 290.9895 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.9895 Da |
| Heavy Atoms | 17 |
| Complexity | 264.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC2=CC=C(C=C2)Br |
| InChIKey | OWWOJXUVGYXFIJ-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Bromoanilino)benzoic acid
Property Insights of 2-(4-Bromoanilino)benzoic acid
The XLogP value of 5.1 indicates that 2-(4-Bromoanilino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.3 Ų, 2-(4-Bromoanilino)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Bromoanilino)benzoic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2-(4-Bromoanilino)benzoic acid?
The CAS number of 2-(4-Bromoanilino)benzoic acid is 13305-94-7.
What is the molecular formula of 2-(4-Bromoanilino)benzoic acid?
The molecular formula of 2-(4-Bromoanilino)benzoic acid is C13H10BrNO2.
What is the molecular weight of 2-(4-Bromoanilino)benzoic acid?
The molecular weight of 2-(4-Bromoanilino)benzoic acid is 290.9895 g/mol.
Where can I buy 2-(4-Bromoanilino)benzoic acid?
You can request a quote for 2-(4-Bromoanilino)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Bromoanilino)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 2-(4-Bromoanilino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.