methyl 4-dodecoxy-2-hydroxybenzoate
TL;DR: methyl 4-dodecoxy-2-hydroxybenzoate (CAS 86840-98-4) is a chemical compound with molecular formula C20H32O4 and molecular weight 336.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-dodecoxy-2-hydroxybenzoate
Also Known As: methyl 4-dodecoxy-2-hydroxybenzoate, methyl 4-dodecyloxy-2-hydroxybenzoate, Methyl 4-dodecoxy-2-hydroxy-benzoate, METHYL 4-(DODECYLOXY)-2-HYDROXYBENZOATE, Benzoic acid, 4-(dodecyloxy)-2-hydroxy-, methyl ester
| Molecular Formula | C20H32O4 |
|---|---|
| Molecular Weight | 336.23 g/mol |
| LogP | 5.4785 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 336.23007 |
| Heavy Atoms | 24 |
| Complexity | 470.7067 |
Chemical Identifiers
| CAS Number | 86840-98-4 |
|---|---|
| SMILES | CCCCCCCCCCCCOC1=CC(=C(C=C1)C(=O)OC)O |
Product Overview
methyl 4-dodecoxy-2-hydroxybenzoate (CAS 86840-98-4), with molecular formula C20H32O4 and molecular weight 336.23 g/mol. IUPAC: methyl 4-dodecoxy-2-hydroxybenzoate.
Chemical Property Profile of methyl 4-dodecoxy-2-hydroxybenzoate
Property Insights of methyl 4-dodecoxy-2-hydroxybenzoate
The XLogP value of 5.4785 indicates that methyl 4-dodecoxy-2-hydroxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.76 Ų, methyl 4-dodecoxy-2-hydroxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 4-dodecoxy-2-hydroxybenzoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 4-dodecoxy-2-hydroxybenzoate?
The CAS number of methyl 4-dodecoxy-2-hydroxybenzoate is 86840-98-4.
What is the molecular formula of methyl 4-dodecoxy-2-hydroxybenzoate?
The molecular formula of methyl 4-dodecoxy-2-hydroxybenzoate is C20H32O4.
What is the molecular weight of methyl 4-dodecoxy-2-hydroxybenzoate?
The molecular weight of methyl 4-dodecoxy-2-hydroxybenzoate is 336.23 g/mol.
Where can I buy methyl 4-dodecoxy-2-hydroxybenzoate?
You can request a quote for methyl 4-dodecoxy-2-hydroxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-dodecoxy-2-hydroxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-dodecoxy-2-hydroxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.