2-氯-4-羟基-5-甲氧基苯甲酸
TL;DR: 2-氯-4-羟基-5-甲氧基苯甲酸 (CAS 62936-24-7) is a chemical compound with molecular formula C8H7ClO4 and molecular weight 202.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氯-4-羟基-5-甲氧基苯甲酸
2-chloro-4-hydroxy-5-methoxybenzoic acid
Also Known As: 6-Chlorovanillic acid, 2-CHLORO-4-HYDROXY-5-METHOXYBENZOIC ACID, Benzoic acid, 2-chloro-4-hydroxy-5-methoxy-, 869-046-4, RefChem:565531
| Molecular Formula | C8H7ClO4 |
|---|---|
| Molecular Weight | 202.00 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.00328 |
| Heavy Atoms | 13 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 62936-24-7 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C(=O)O)Cl)O |
| InChIKey | CWAVFSFCVCDDEM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氯-4-羟基-5-甲氧基苯甲酸 (CAS 62936-24-7), with molecular formula C8H7ClO4 and molecular weight 202.00 g/mol. IUPAC: 2-chloro-4-hydroxy-5-methoxybenzoic acid.
Chemical Property Profile of 2-氯-4-羟基-5-甲氧基苯甲酸
Property Insights of 2-氯-4-羟基-5-甲氧基苯甲酸
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氯-4-羟基-5-甲氧基苯甲酸. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-氯-4-羟基-5-甲氧基苯甲酸. Following Lipinski's Rule of Five, 2-氯-4-羟基-5-甲氧基苯甲酸 has 2 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 2-氯-4-羟基-5-甲氧基苯甲酸?
The CAS number of 2-氯-4-羟基-5-甲氧基苯甲酸 is 62936-24-7.
What is the molecular formula of 2-氯-4-羟基-5-甲氧基苯甲酸?
The molecular formula of 2-氯-4-羟基-5-甲氧基苯甲酸 is C8H7ClO4.
What is the molecular weight of 2-氯-4-羟基-5-甲氧基苯甲酸?
The molecular weight of 2-氯-4-羟基-5-甲氧基苯甲酸 is 202.00 g/mol.
Where can I buy 2-氯-4-羟基-5-甲氧基苯甲酸?
You can request a quote for 2-氯-4-羟基-5-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 2-氯-4-羟基-5-甲氧基苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 2-氯-4-羟基-5-甲氧基苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.