Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy-
TL;DR: Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy- (CAS 76341-70-3) is a chemical compound with molecular formula C9H9ClO5 and molecular weight 232.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-hydroxy-3,5-dimethoxybenzoic acid
Also Known As: 2-chloro-4-hydroxy-3,5-dimethoxybenzoic acid, Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy-, 2-chloro-4-hydroxy-3,5-dimethoxy-benzoic acid, Benzoic acid,2-chloro-4-hydroxy-3,5-dimethoxy
| Molecular Formula | C9H9ClO5 |
|---|---|
| Molecular Weight | 232.01 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.01385 |
| Heavy Atoms | 15 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 76341-70-3 |
|---|---|
| SMILES | COC1=C(C(=C(C(=C1)C(=O)O)Cl)OC)O |
| InChIKey | SZKVBSBSSNHHBQ-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy- (CAS 76341-70-3), with molecular formula C9H9ClO5 and molecular weight 232.01 g/mol. IUPAC: 2-chloro-4-hydroxy-3,5-dimethoxybenzoic acid.
Chemical Property Profile of Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy-
Property Insights of Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy-. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy-. Following Lipinski's Rule of Five, Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy- has 2 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 Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy-?
The CAS number of Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy- is 76341-70-3.
What is the molecular formula of Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy-?
The molecular formula of Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy- is C9H9ClO5.
What is the molecular weight of Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy-?
The molecular weight of Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy- is 232.01 g/mol.
Where can I buy Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy-?
You can request a quote for Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-chloro-4-hydroxy-3,5-dimethoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.