Methyl 4-(hexadecyloxy)benzoate
TL;DR: Methyl 4-(hexadecyloxy)benzoate (CAS 40654-35-1) is a chemical compound with molecular formula C24H40O3 and molecular weight 376.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-hexadecoxybenzoate
Also Known As: Methyl p-Hexadecyloxybenzoate, Methyl 4-hexadecoxybenzoate, methyl 4-n-hexadecyloxybenzoate, Methyl 4-hexadecyloxybenzoate, METHYL 4-(HEXADECYLOXY)BENZOATE
| Molecular Formula | C24H40O3 |
|---|---|
| Molecular Weight | 376.30 g/mol |
| LogP | 7.3333 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 376.29776 |
| Heavy Atoms | 27 |
| Complexity | 467.01956 |
Chemical Identifiers
| CAS Number | 40654-35-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC |
Product Overview
Methyl 4-(hexadecyloxy)benzoate (CAS 40654-35-1), with molecular formula C24H40O3 and molecular weight 376.30 g/mol. IUPAC: methyl 4-hexadecoxybenzoate.
Chemical Property Profile of Methyl 4-(hexadecyloxy)benzoate
Property Insights of Methyl 4-(hexadecyloxy)benzoate
The XLogP value of 7.3333 indicates that Methyl 4-(hexadecyloxy)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Methyl 4-(hexadecyloxy)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-(hexadecyloxy)benzoate has 0 hydrogen bond donor(s) and 3 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-(hexadecyloxy)benzoate?
The CAS number of Methyl 4-(hexadecyloxy)benzoate is 40654-35-1.
What is the molecular formula of Methyl 4-(hexadecyloxy)benzoate?
The molecular formula of Methyl 4-(hexadecyloxy)benzoate is C24H40O3.
What is the molecular weight of Methyl 4-(hexadecyloxy)benzoate?
The molecular weight of Methyl 4-(hexadecyloxy)benzoate is 376.30 g/mol.
Where can I buy Methyl 4-(hexadecyloxy)benzoate?
You can request a quote for Methyl 4-(hexadecyloxy)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-(hexadecyloxy)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(hexadecyloxy)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.