Hexadecyl hexadec-9-enoate
TL;DR: Hexadecyl hexadec-9-enoate (CAS 87896-47-7) is a chemical compound with molecular formula C32H62O2 and molecular weight 478.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexadecyl hexadec-9-enoate
Also Known As: HEXADECYL HEXADEC-9-ENOATE, 9-hexadecenoic acid-hexadecyl ester, RefChem:347486
| Molecular Formula | C32H62O2 |
|---|---|
| Molecular Weight | 478.47 g/mol |
| LogP | 14.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 29 |
| Exact Mass | 478.47498 |
| Heavy Atoms | 34 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 87896-47-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC(=O)CCCCCCCC=CCCCCCC |
| InChIKey | YEHRXIRYXGNEDS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexadecyl hexadec-9-enoate (CAS 87896-47-7), with molecular formula C32H62O2 and molecular weight 478.47 g/mol. IUPAC: hexadecyl hexadec-9-enoate.
Chemical Property Profile of Hexadecyl hexadec-9-enoate
Property Insights of Hexadecyl hexadec-9-enoate
The XLogP value of 14.3 indicates that Hexadecyl hexadec-9-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Hexadecyl hexadec-9-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexadecyl hexadec-9-enoate 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 Hexadecyl hexadec-9-enoate?
The CAS number of Hexadecyl hexadec-9-enoate is 87896-47-7.
What is the molecular formula of Hexadecyl hexadec-9-enoate?
The molecular formula of Hexadecyl hexadec-9-enoate is C32H62O2.
What is the molecular weight of Hexadecyl hexadec-9-enoate?
The molecular weight of Hexadecyl hexadec-9-enoate is 478.47 g/mol.
Where can I buy Hexadecyl hexadec-9-enoate?
You can request a quote for Hexadecyl hexadec-9-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexadecyl hexadec-9-enoate?
Yes, KEHONG BIO provides custom synthesis services for Hexadecyl hexadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.