Methyl 4-chloro-1-hydroxy-2-naphthoate
TL;DR: Methyl 4-chloro-1-hydroxy-2-naphthoate (CAS 135241-08-6) is a chemical compound with molecular formula C12H9ClO3 and molecular weight 236.02402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-chloro-1-hydroxynaphthalene-2-carboxylate
Also Known As: methyl 4-chloro-1-hydroxy-2-naphthoate, methyl 4-chloro-1-hydroxynaphthalene-2-carboxylate, methyl4-chloro-1-hydroxy-2-naphthoate, Methyl 4-chloro-1-hydroxy-2-naphthalenecarboxylate, methyl 4-chloro-1-hydroxy-naphthalene-2-carboxylate
Technical Specifications
| Molecular Formula | C12H9ClO3 |
| Molecular Weight | 236.02402 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.02402 Da |
| Heavy Atoms | 16 |
| Complexity | 269.0 |
| SMILES | COC(=O)C1=C(C2=CC=CC=C2C(=C1)Cl)O |
| InChIKey | YXHHYWLUQOYFSN-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-chloro-1-hydroxy-2-naphthoate
Property Insights of Methyl 4-chloro-1-hydroxy-2-naphthoate
The XLogP value of 4.5 indicates that Methyl 4-chloro-1-hydroxy-2-naphthoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Methyl 4-chloro-1-hydroxy-2-naphthoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-chloro-1-hydroxy-2-naphthoate 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
What is the CAS number of Methyl 4-chloro-1-hydroxy-2-naphthoate?
The CAS number of Methyl 4-chloro-1-hydroxy-2-naphthoate is 135241-08-6.
What is the molecular formula of Methyl 4-chloro-1-hydroxy-2-naphthoate?
The molecular formula of Methyl 4-chloro-1-hydroxy-2-naphthoate is C12H9ClO3.
What is the molecular weight of Methyl 4-chloro-1-hydroxy-2-naphthoate?
The molecular weight of Methyl 4-chloro-1-hydroxy-2-naphthoate is 236.02402 g/mol.
Where can I buy Methyl 4-chloro-1-hydroxy-2-naphthoate?
You can request a quote for Methyl 4-chloro-1-hydroxy-2-naphthoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-chloro-1-hydroxy-2-naphthoate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-chloro-1-hydroxy-2-naphthoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.