1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)-
TL;DR: 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)- (CAS 68140-99-8) is a chemical compound with molecular formula C22H20N2O4 and molecular weight 376.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-bis(2-methylanilino)terephthalic acid
Also Known As: 2,5-Di-o-toluidinoterephthalic acid, Terephthalic acid, 2,5-bis(o-toluidino)-, 2,5-Di(o-toluidino)terephthalic acid, 2,5-Bis((methylphenyl)amino)terephthalic acid, 2,5-bis(o-tolylamino)terephthalic acid
| Molecular Formula | C22H20N2O4 |
|---|---|
| Molecular Weight | 376.14 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 376.1423 |
| Heavy Atoms | 28 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 68140-99-8 |
|---|---|
| SMILES | CC1=CC=CC=C1NC2=CC(=C(C=C2C(=O)O)NC3=CC=CC=C3C)C(=O)O |
| InChIKey | XJNWPYYRBAQKNJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)- (CAS 68140-99-8), with molecular formula C22H20N2O4 and molecular weight 376.14 g/mol. IUPAC: 2,5-bis(2-methylanilino)terephthalic acid.
Chemical Property Profile of 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)-
Property Insights of 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)-
The XLogP value of 5.9 indicates that 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)-. Following Lipinski's Rule of Five, 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)- has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)-?
The CAS number of 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)- is 68140-99-8.
What is the molecular formula of 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)-?
The molecular formula of 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)- is C22H20N2O4.
What is the molecular weight of 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)-?
The molecular weight of 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)- is 376.14 g/mol.
Where can I buy 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)-?
You can request a quote for 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Benzenedicarboxylic acid, 2,5-bis((2-methylphenyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.