5-氯-2,4-二羟基苯甲酸
TL;DR: 5-氯-2,4-二羟基苯甲酸 (CAS 67828-44-8) is a chemical compound with molecular formula C7H5ClO4 and molecular weight 187.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-氯-2,4-二羟基苯甲酸
5-chloro-2,4-dihydroxybenzoic acid
Also Known As: 5-Chloro-2,4-dihydroxybenzoic acid, 5-Chloro-beta-resorcylic acid, 5-Chloro-4-hydroxysalicylic acid, Benzoic acid,5-chloro-2,4-dihydroxy-, Benzoic acid, 5-chloro-2,4-dihydroxy-
| Molecular Formula | C7H5ClO4 |
|---|---|
| Molecular Weight | 187.99 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 187.98764 |
| Heavy Atoms | 12 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 67828-44-8 |
|---|---|
| SMILES | C1=C(C(=CC(=C1Cl)O)O)C(=O)O |
| InChIKey | SAZOOWOGQNYJLS-UHFFFAOYSA-N |
Product Overview
5-氯-2,4-二羟基苯甲酸 (CAS 67828-44-8), with molecular formula C7H5ClO4 and molecular weight 187.99 g/mol. IUPAC: 5-chloro-2,4-dihydroxybenzoic acid.
Chemical Property Profile of 5-氯-2,4-二羟基苯甲酸
Property Insights of 5-氯-2,4-二羟基苯甲酸
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-氯-2,4-二羟基苯甲酸. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-氯-2,4-二羟基苯甲酸. Following Lipinski's Rule of Five, 5-氯-2,4-二羟基苯甲酸 has 3 hydrogen bond donor(s) and 4 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-氯-2,4-二羟基苯甲酸?
The CAS number of 5-氯-2,4-二羟基苯甲酸 is 67828-44-8.
What is the molecular formula of 5-氯-2,4-二羟基苯甲酸?
The molecular formula of 5-氯-2,4-二羟基苯甲酸 is C7H5ClO4.
What is the molecular weight of 5-氯-2,4-二羟基苯甲酸?
The molecular weight of 5-氯-2,4-二羟基苯甲酸 is 187.99 g/mol.
Where can I buy 5-氯-2,4-二羟基苯甲酸?
You can request a quote for 5-氯-2,4-二羟基苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-氯-2,4-二羟基苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 5-氯-2,4-二羟基苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.