3,5-二碘邻茴香酸
TL;DR: 3,5-二碘邻茴香酸 (CAS 19094-55-4) is a chemical compound with molecular formula C8H6I2O3 and molecular weight 403.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-二碘邻茴香酸
3,5-diiodo-2-methoxybenzoic acid
Also Known As: 3,5-Diiodo-2-methoxybenzoic acid, 3,5-Diiodo-o-anisic acid, o-ANISIC ACID, 3,5-DIIODO-, 3-10-00-00189 (Beilstein Handbook Reference), BRN 2723364
| Molecular Formula | C8H6I2O3 |
|---|---|
| Molecular Weight | 403.84 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 403.84064 |
| Heavy Atoms | 13 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 19094-55-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1I)I)C(=O)O |
| InChIKey | HLZOAFKJWZBDPO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-二碘邻茴香酸 (CAS 19094-55-4), with molecular formula C8H6I2O3 and molecular weight 403.84 g/mol. IUPAC: 3,5-diiodo-2-methoxybenzoic acid.
Chemical Property Profile of 3,5-二碘邻茴香酸
Property Insights of 3,5-二碘邻茴香酸
The XLogP value of 4.3 indicates that 3,5-二碘邻茴香酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 3,5-二碘邻茴香酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-二碘邻茴香酸 has 1 hydrogen bond donor(s) and 3 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 3,5-二碘邻茴香酸?
The CAS number of 3,5-二碘邻茴香酸 is 19094-55-4.
What is the molecular formula of 3,5-二碘邻茴香酸?
The molecular formula of 3,5-二碘邻茴香酸 is C8H6I2O3.
What is the molecular weight of 3,5-二碘邻茴香酸?
The molecular weight of 3,5-二碘邻茴香酸 is 403.84 g/mol.
Where can I buy 3,5-二碘邻茴香酸?
You can request a quote for 3,5-二碘邻茴香酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-二碘邻茴香酸?
Yes, KEHONG BIO provides custom synthesis services for 3,5-二碘邻茴香酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.