5-Tert-Butyl-2-Methoxybenzoic Acid
TL;DR: 5-Tert-Butyl-2-Methoxybenzoic Acid (CAS 73469-54-2) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-tert-butyl-2-methoxybenzoic acid
Also Known As: 5-(tert-butyl)-2-methoxybenzoic acid, 5-TERT-BUTYL-2-METHOXYBENZOIC ACID, 4-tert-Butyl-2-ethoxy-benzoic acid, FMOC-D-ASP-NH2, 2-methoxy-5-tert-butylbenzoic acid
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 2.6909 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 374.94388 |
Chemical Identifiers
| CAS Number | 73469-54-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)OC)C(=O)O |
Product Overview
5-Tert-Butyl-2-Methoxybenzoic Acid (CAS 73469-54-2), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: 5-tert-butyl-2-methoxybenzoic acid.
Chemical Property Profile of 5-Tert-Butyl-2-Methoxybenzoic Acid
Property Insights of 5-Tert-Butyl-2-Methoxybenzoic Acid
The XLogP value of 2.6909 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Tert-Butyl-2-Methoxybenzoic Acid. With a topological polar surface area (TPSA) of 46.53 Ų, 5-Tert-Butyl-2-Methoxybenzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Tert-Butyl-2-Methoxybenzoic Acid has 1 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 5-Tert-Butyl-2-Methoxybenzoic Acid?
The CAS number of 5-Tert-Butyl-2-Methoxybenzoic Acid is 73469-54-2.
What is the molecular formula of 5-Tert-Butyl-2-Methoxybenzoic Acid?
The molecular formula of 5-Tert-Butyl-2-Methoxybenzoic Acid is C12H16O3.
What is the molecular weight of 5-Tert-Butyl-2-Methoxybenzoic Acid?
The molecular weight of 5-Tert-Butyl-2-Methoxybenzoic Acid is 208.11 g/mol.
Where can I buy 5-Tert-Butyl-2-Methoxybenzoic Acid?
You can request a quote for 5-Tert-Butyl-2-Methoxybenzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Tert-Butyl-2-Methoxybenzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Tert-Butyl-2-Methoxybenzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.