Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate
TL;DR: Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate (CAS 77499-94-6) is a chemical compound with molecular formula C14H14O4 and molecular weight 246.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-hydroxy-5-methoxy-7-methylnaphthalene-1-carboxylate
Also Known As: MH-5-MM-1-nhecb, Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate, methyl 2-hydroxy-5-methoxy-7-methylnaphthalene-1-carboxylate, methyl2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate, 1-Naphthalenecarboxylic acid, 2-hydroxy-5-methoxy-7-methyl-, methyl ester
| Molecular Formula | C14H14O4 |
|---|---|
| Molecular Weight | 246.09 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.0892 |
| Heavy Atoms | 18 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 77499-94-6 |
|---|---|
| SMILES | CC1=CC2=C(C=CC(=C2C(=O)OC)O)C(=C1)OC |
| InChIKey | COGZIBOEGJEVSW-UHFFFAOYSA-N |
Product Overview
Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate (CAS 77499-94-6), with molecular formula C14H14O4 and molecular weight 246.09 g/mol. IUPAC: methyl 2-hydroxy-5-methoxy-7-methylnaphthalene-1-carboxylate.
Chemical Property Profile of Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate
Property Insights of Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate
The XLogP value of 3.6 indicates that Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate has 1 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 Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate?
The CAS number of Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate is 77499-94-6.
What is the molecular formula of Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate?
The molecular formula of Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate is C14H14O4.
What is the molecular weight of Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate?
The molecular weight of Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate is 246.09 g/mol.
Where can I buy Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate?
You can request a quote for Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-hydroxy-5-methoxy-7-methyl-1-naphthalenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.