2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid
TL;DR: 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid (CAS 23342-29-2) is a chemical compound with molecular formula C14H18O4 and molecular weight 250.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid
Also Known As: Maybridge1_002408, DivK1c_001160, 2-(2-carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid, CDS1_000120, 2- -4,6-DIMETHYLBENZOICACID
| Molecular Formula | C14H18O4 |
|---|---|
| Molecular Weight | 250.12 g/mol |
| LogP | 2.65494 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.12051 |
| Heavy Atoms | 18 |
| Complexity | 500.76062 |
Chemical Identifiers
| CAS Number | 23342-29-2 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)CC(C)(C)C(=O)O)C(=O)O)C |
Product Overview
2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid (CAS 23342-29-2), with molecular formula C14H18O4 and molecular weight 250.12 g/mol. IUPAC: 2-(2-carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid.
Chemical Property Profile of 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid
Property Insights of 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid
The XLogP value of 2.65494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid. Following Lipinski's Rule of Five, 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid has 2 hydrogen bond donor(s) and 2 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-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid?
The CAS number of 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid is 23342-29-2.
What is the molecular formula of 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid?
The molecular formula of 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid is C14H18O4.
What is the molecular weight of 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid?
The molecular weight of 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid is 250.12 g/mol.
Where can I buy 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid?
You can request a quote for 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.