Methyl nonacosanoate
TL;DR: Methyl nonacosanoate (CAS 4082-55-7) is a chemical compound with molecular formula C30H60O2 and molecular weight 452.46 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl nonacosanoate
Also Known As: METHYL NONACOSANOATE, Methyl nonacosan-1-oate, METHYLNONACOSANOATE, Nonacosanoic acid, methyl ester, Nonacosanoic acid methyl ester
| Molecular Formula | C30H60O2 |
|---|---|
| Molecular Weight | 452.46 g/mol |
| LogP | 15.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 28 |
| Exact Mass | 452.45932 |
| Heavy Atoms | 32 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 4082-55-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC |
| InChIKey | WGNBXLBBAVTMCK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl nonacosanoate (CAS 4082-55-7), with molecular formula C30H60O2 and molecular weight 452.46 g/mol. IUPAC: methyl nonacosanoate.
Chemical Property Profile of Methyl nonacosanoate
Property Insights of Methyl nonacosanoate
The XLogP value of 15.0 indicates that Methyl nonacosanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl nonacosanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl nonacosanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl nonacosanoate?
The CAS number of Methyl nonacosanoate is 4082-55-7.
What is the molecular formula of Methyl nonacosanoate?
The molecular formula of Methyl nonacosanoate is C30H60O2.
What is the molecular weight of Methyl nonacosanoate?
The molecular weight of Methyl nonacosanoate is 452.46 g/mol.
Where can I buy Methyl nonacosanoate?
You can request a quote for Methyl nonacosanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl nonacosanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl nonacosanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.