2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid
TL;DR: 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid (CAS 1009286-34-3) is a chemical compound with molecular formula C15H13N3O6 and molecular weight 331.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-2,6-dinitroanilino)-2-phenylacetic acid
Also Known As: 2-(4-methyl-2,6-dinitroanilino)-2-phenylacetic acid, 2-[(4-methyl-2,6-dinitrophenyl)amino]-2-phenylacetic acid, 2-(4-methyl-2,6-dinitro-anilino)-2-phenyl-acetic acid, 2-[(4-methyl-2,6-dinitrophenyl)amino]-2-phenylaceticacid, 2-[(4-methyl-2,6-dinitro-phenyl)amino]-2-phenyl-acetic Acid
| Molecular Formula | C15H13N3O6 |
|---|---|
| Molecular Weight | 331.08 g/mol |
| LogP | 3.04922 |
| Topological Polar Surface Area | 135.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.08044 |
| Heavy Atoms | 24 |
| Complexity | 771.10675 |
Chemical Identifiers
| CAS Number | 1009286-34-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)[N+](=O)[O-])NC(C2=CC=CC=C2)C(=O)O)[N+](=O)[O-] |
Product Overview
2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid (CAS 1009286-34-3), with molecular formula C15H13N3O6 and molecular weight 331.08 g/mol. IUPAC: 2-(4-methyl-2,6-dinitroanilino)-2-phenylacetic acid.
Chemical Property Profile of 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid
Property Insights of 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid
The XLogP value of 3.04922 indicates that 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid. Following Lipinski's Rule of Five, 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid?
The CAS number of 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid is 1009286-34-3.
What is the molecular formula of 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid?
The molecular formula of 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid is C15H13N3O6.
What is the molecular weight of 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid?
The molecular weight of 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid is 331.08 g/mol.
Where can I buy 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid?
You can request a quote for 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methyl-2,6-dinitroanilino)-2-phenylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.