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Benzoic acid, 2-[(3,4-dimethylphenyl)amino]-
TL;DR: Benzoic acid, 2-[(3,4-dimethylphenyl)amino]- (CAS 39492-53-0) is a chemical compound with molecular formula C15H15NO2 and molecular weight 241.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethylanilino)benzoic acid
Also Known As: 2-(3,4-dimethylanilino)benzoic acid, N-(2.3-Xylyl)-anthranilsaeure, Benzoic acid, 2-[(3,4-dimethylphenyl)amino]-, N-(3,4-Dimethylphenyl)anthranilic Acid, 2-(3,4-Dimethyl-phenylamino)-benzoic acid
| Molecular Formula | C15H15NO2 |
|---|---|
| Molecular Weight | 241.11 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.11028 |
| Heavy Atoms | 18 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 39492-53-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=CC=CC=C2C(=O)O)C |
| InChIKey | HGAQNVCHFGXGKU-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 2-[(3,4-dimethylphenyl)amino]- (CAS 39492-53-0), with molecular formula C15H15NO2 and molecular weight 241.11 g/mol. IUPAC: 2-(3,4-dimethylanilino)benzoic acid.
Chemical Property Profile of Benzoic acid, 2-[(3,4-dimethylphenyl)amino]-
Property Insights of Benzoic acid, 2-[(3,4-dimethylphenyl)amino]-
The XLogP value of 5.1 indicates that Benzoic acid, 2-[(3,4-dimethylphenyl)amino]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.3 Ų, Benzoic acid, 2-[(3,4-dimethylphenyl)amino]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 2-[(3,4-dimethylphenyl)amino]- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzoic acid, 2-[(3,4-dimethylphenyl)amino]-?
The CAS number of Benzoic acid, 2-[(3,4-dimethylphenyl)amino]- is 39492-53-0.
What is the molecular formula of Benzoic acid, 2-[(3,4-dimethylphenyl)amino]-?
The molecular formula of Benzoic acid, 2-[(3,4-dimethylphenyl)amino]- is C15H15NO2.
What is the molecular weight of Benzoic acid, 2-[(3,4-dimethylphenyl)amino]-?
The molecular weight of Benzoic acid, 2-[(3,4-dimethylphenyl)amino]- is 241.11 g/mol.
Where can I buy Benzoic acid, 2-[(3,4-dimethylphenyl)amino]-?
You can request a quote for Benzoic acid, 2-[(3,4-dimethylphenyl)amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-[(3,4-dimethylphenyl)amino]-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-[(3,4-dimethylphenyl)amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.