Methyl 12-acetoxyoctadec-9-enoate
TL;DR: Methyl 12-acetoxyoctadec-9-enoate (CAS 140-03-4) is a chemical compound with molecular formula C21H38O4 and molecular weight 354.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 12-acetyloxyoctadec-9-enoate
Also Known As: Flexricin P-4, Methyl acetyl ricinoleate, Methyl 12-acetoxyoleate, Methyl O-acetylricinoleate, METHYL ACETYLRICINOLEATE
| Molecular Formula | C21H38O4 |
|---|---|
| Molecular Weight | 354.28 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 354.277 |
| Heavy Atoms | 25 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 140-03-4 |
|---|---|
| SMILES | CCCCCCC(CC=CCCCCCCCC(=O)OC)OC(=O)C |
| InChIKey | CMOYPQWMTBSLJK-UHFFFAOYSA-N |
Product Overview
Methyl 12-acetoxyoctadec-9-enoate (CAS 140-03-4), with molecular formula C21H38O4 and molecular weight 354.28 g/mol. IUPAC: methyl 12-acetyloxyoctadec-9-enoate.
Chemical Property Profile of Methyl 12-acetoxyoctadec-9-enoate
Property Insights of Methyl 12-acetoxyoctadec-9-enoate
The XLogP value of 6.6 indicates that Methyl 12-acetoxyoctadec-9-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Methyl 12-acetoxyoctadec-9-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 12-acetoxyoctadec-9-enoate has 0 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 12-acetoxyoctadec-9-enoate?
The CAS number of Methyl 12-acetoxyoctadec-9-enoate is 140-03-4.
What is the molecular formula of Methyl 12-acetoxyoctadec-9-enoate?
The molecular formula of Methyl 12-acetoxyoctadec-9-enoate is C21H38O4.
What is the molecular weight of Methyl 12-acetoxyoctadec-9-enoate?
The molecular weight of Methyl 12-acetoxyoctadec-9-enoate is 354.28 g/mol.
Where can I buy Methyl 12-acetoxyoctadec-9-enoate?
You can request a quote for Methyl 12-acetoxyoctadec-9-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 12-acetoxyoctadec-9-enoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 12-acetoxyoctadec-9-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.