Octadecyl triacontanoate
TL;DR: Octadecyl triacontanoate (CAS 104932-96-9) is a chemical compound with molecular formula C48H96O2 and molecular weight 704.74 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octadecyl triacontanoate
Also Known As: octadecyl triacontanoate, Stearyl triacontanoate, Triacontanoic acid, octadecyl ester, Triacontanoic acid stearyl ester, J3.752.295C
| Molecular Formula | C48H96O2 |
|---|---|
| Molecular Weight | 704.74 g/mol |
| LogP | 23.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 46 |
| Exact Mass | 704.741 |
| Heavy Atoms | 50 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 104932-96-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCCCC |
| InChIKey | OMUUHPZWWNIVEP-UHFFFAOYSA-N |
Product Overview
Octadecyl triacontanoate (CAS 104932-96-9), with molecular formula C48H96O2 and molecular weight 704.74 g/mol. IUPAC: octadecyl triacontanoate.
Chemical Property Profile of Octadecyl triacontanoate
Property Insights of Octadecyl triacontanoate
The XLogP value of 23.9 indicates that Octadecyl triacontanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Octadecyl triacontanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadecyl triacontanoate 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 Octadecyl triacontanoate?
The CAS number of Octadecyl triacontanoate is 104932-96-9.
What is the molecular formula of Octadecyl triacontanoate?
The molecular formula of Octadecyl triacontanoate is C48H96O2.
What is the molecular weight of Octadecyl triacontanoate?
The molecular weight of Octadecyl triacontanoate is 704.74 g/mol.
Where can I buy Octadecyl triacontanoate?
You can request a quote for Octadecyl triacontanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecyl triacontanoate?
Yes, KEHONG BIO provides custom synthesis services for Octadecyl triacontanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.