2,6-bis(3-methylphenyl)benzoic Acid
TL;DR: 2,6-bis(3-methylphenyl)benzoic Acid (CAS 167500-09-6) is a chemical compound with molecular formula C21H18O2 and molecular weight 302.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-bis(3-methylphenyl)benzoic acid
Also Known As: 2,6-bis(3-methylphenyl)benzoic Acid, 3,3''-DIMETHYL-(1,1',3',1'')TERPHENYL-2'-CARBOXYLIC ACID
Technical Specifications
| Molecular Formula | C21H18O2 |
| Molecular Weight | 302.13068 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.13068 Da |
| Heavy Atoms | 23 |
| Complexity | 375.0 |
| SMILES | CC1=CC(=CC=C1)C2=C(C(=CC=C2)C3=CC=CC(=C3)C)C(=O)O |
| InChIKey | CXRBTVICLMOOCO-UHFFFAOYSA-N |
Chemical Property Profile of 2,6-bis(3-methylphenyl)benzoic Acid
Property Insights of 2,6-bis(3-methylphenyl)benzoic Acid
The XLogP value of 5.4 indicates that 2,6-bis(3-methylphenyl)benzoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2,6-bis(3-methylphenyl)benzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-bis(3-methylphenyl)benzoic Acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2,6-bis(3-methylphenyl)benzoic Acid?
The CAS number of 2,6-bis(3-methylphenyl)benzoic Acid is 167500-09-6.
What is the molecular formula of 2,6-bis(3-methylphenyl)benzoic Acid?
The molecular formula of 2,6-bis(3-methylphenyl)benzoic Acid is C21H18O2.
What is the molecular weight of 2,6-bis(3-methylphenyl)benzoic Acid?
The molecular weight of 2,6-bis(3-methylphenyl)benzoic Acid is 302.13068 g/mol.
Where can I buy 2,6-bis(3-methylphenyl)benzoic Acid?
You can request a quote for 2,6-bis(3-methylphenyl)benzoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,6-bis(3-methylphenyl)benzoic Acid?
Yes, CoreyChem provides custom synthesis services for 2,6-bis(3-methylphenyl)benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.