3,5-Diiodo-2-methylbenzoic acid
TL;DR: 3,5-Diiodo-2-methylbenzoic acid (CAS 10388-25-7) is a chemical compound with molecular formula C8H6I2O2 and molecular weight 387.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-diiodo-2-methylbenzoic acid
Also Known As: 3,5-diiodo-2-methylbenzoic acid, Canagliflozin Impurity 95, 3,5-diiodo-2-methyl benzoic acid, 3,5-diiodo-2-methyl-benzoic Acid
| Molecular Formula | C8H6I2O2 |
|---|---|
| Molecular Weight | 387.85 g/mol |
| LogP | 2.90242 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 387.84573 |
| Heavy Atoms | 12 |
| Complexity | 334.0749 |
Chemical Identifiers
| CAS Number | 10388-25-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1I)I)C(=O)O |
Product Overview
3,5-Diiodo-2-methylbenzoic acid (CAS 10388-25-7), with molecular formula C8H6I2O2 and molecular weight 387.85 g/mol. IUPAC: 3,5-diiodo-2-methylbenzoic acid.
Chemical Property Profile of 3,5-Diiodo-2-methylbenzoic acid
Property Insights of 3,5-Diiodo-2-methylbenzoic acid
The XLogP value of 2.90242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Diiodo-2-methylbenzoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3,5-Diiodo-2-methylbenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Diiodo-2-methylbenzoic acid has 1 hydrogen bond donor(s) and 1 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 3,5-Diiodo-2-methylbenzoic acid?
The CAS number of 3,5-Diiodo-2-methylbenzoic acid is 10388-25-7.
What is the molecular formula of 3,5-Diiodo-2-methylbenzoic acid?
The molecular formula of 3,5-Diiodo-2-methylbenzoic acid is C8H6I2O2.
What is the molecular weight of 3,5-Diiodo-2-methylbenzoic acid?
The molecular weight of 3,5-Diiodo-2-methylbenzoic acid is 387.85 g/mol.
Where can I buy 3,5-Diiodo-2-methylbenzoic acid?
You can request a quote for 3,5-Diiodo-2-methylbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Diiodo-2-methylbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Diiodo-2-methylbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.