Benzoic acid, 6-bromo-2,3,4-trimethoxy-
TL;DR: Benzoic acid, 6-bromo-2,3,4-trimethoxy- (CAS 139214-72-5) is a chemical compound with molecular formula C10H11BrO5 and molecular weight 289.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Benzoic acid, 6-bromo-2,3,4-trimethoxy-
6-bromo-2,3,4-trimethoxybenzoic acid
Also Known As: 6-bromo-2,3,4-trimethoxybenzoic acid, Benzoic acid, 6-bromo-2,3,4-trimethoxy-
| Molecular Formula | C10H11BrO5 |
|---|---|
| Molecular Weight | 289.98 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.979 |
| Heavy Atoms | 16 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 139214-72-5 |
|---|---|
| SMILES | COC1=CC(=C(C(=C1OC)OC)C(=O)O)Br |
| InChIKey | ZYKHRMOHIUJAJE-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 6-bromo-2,3,4-trimethoxy- (CAS 139214-72-5), with molecular formula C10H11BrO5 and molecular weight 289.98 g/mol. IUPAC: 6-bromo-2,3,4-trimethoxybenzoic acid.
Chemical Property Profile of Benzoic acid, 6-bromo-2,3,4-trimethoxy-
Property Insights of Benzoic acid, 6-bromo-2,3,4-trimethoxy-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 6-bromo-2,3,4-trimethoxy-. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 6-bromo-2,3,4-trimethoxy-. Following Lipinski's Rule of Five, 6-溴-2,3,4-三甲氧基苯甲酸 has 1 hydrogen bond donor(s) and 5 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 6-溴-2,3,4-三甲氧基苯甲酸?
The CAS number of 6-溴-2,3,4-三甲氧基苯甲酸 is 139214-72-5.
What is the molecular formula of 6-溴-2,3,4-三甲氧基苯甲酸?
The molecular formula of 6-溴-2,3,4-三甲氧基苯甲酸 is C10H11BrO5.
What is the molecular weight of 6-溴-2,3,4-三甲氧基苯甲酸?
The molecular weight of 6-溴-2,3,4-三甲氧基苯甲酸 is 289.98 g/mol.
Where can I buy 6-溴-2,3,4-三甲氧基苯甲酸?
You can request a quote for 6-溴-2,3,4-三甲氧基苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-溴-2,3,4-三甲氧基苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 6-溴-2,3,4-三甲氧基苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.