12-Methyl-13-tridecanolide
TL;DR: 12-Methyl-13-tridecanolide (CAS 57092-32-7) is a chemical compound with molecular formula C14H26O2 and molecular weight 226.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-methyl-oxacyclotetradecan-2-one
Also Known As: Isooctyl palmitate, 12-Methyl-13-tridecanolide, 12-Methyltridecanolid, 13-Methyloxacyclotetradecan-2-one, 6-Methylheptyl palmitate
| Molecular Formula | C14H26O2 |
|---|---|
| Molecular Weight | 226.19 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.19328 |
| Heavy Atoms | 16 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 57092-32-7 |
|---|---|
| SMILES | CC1CCCCCCCCCCC(=O)OC1 |
| InChIKey | NFNWPPOMMYDNFQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
12-Methyl-13-tridecanolide (CAS 57092-32-7), with molecular formula C14H26O2 and molecular weight 226.19 g/mol. IUPAC: 13-methyl-oxacyclotetradecan-2-one.
Chemical Property Profile of 12-Methyl-13-tridecanolide
Property Insights of 12-Methyl-13-tridecanolide
The XLogP value of 5.1 indicates that 12-Methyl-13-tridecanolide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 12-Methyl-13-tridecanolide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 12-Methyl-13-tridecanolide 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 12-Methyl-13-tridecanolide?
The CAS number of 12-Methyl-13-tridecanolide is 57092-32-7.
What is the molecular formula of 12-Methyl-13-tridecanolide?
The molecular formula of 12-Methyl-13-tridecanolide is C14H26O2.
What is the molecular weight of 12-Methyl-13-tridecanolide?
The molecular weight of 12-Methyl-13-tridecanolide is 226.19 g/mol.
Where can I buy 12-Methyl-13-tridecanolide?
You can request a quote for 12-Methyl-13-tridecanolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12-Methyl-13-tridecanolide?
Yes, KEHONG BIO provides custom synthesis services for 12-Methyl-13-tridecanolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.