1-Nonanol, 8-methyl-, 1-propanoate
TL;DR: 1-Nonanol, 8-methyl-, 1-propanoate (CAS 67845-27-6) is a chemical compound with molecular formula C13H26O2 and molecular weight 214.19328 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-methylnonyl propanoate
Also Known As: 8-Methylnonyl propanoate, 1-Nonanol, 8-methyl-, propanoate, Propanoicacid8-methylnonylester, 1-Nonanol, 8-methyl-, 1-propanoate, Propanoic acid 8-methylnonyl ester
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H26O2 |
| Molecular Weight | 214.19328 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 214.19328 Da |
| Heavy Atoms | 15 |
| Complexity | 153.0 |
| SMILES | CCC(=O)OCCCCCCCC(C)C |
| InChIKey | MQRHJALDOCJMIY-UHFFFAOYSA-N |
Chemical Property Profile of 1-Nonanol, 8-methyl-, 1-propanoate
Property Insights of 1-Nonanol, 8-methyl-, 1-propanoate
The XLogP value of 4.8 indicates that 1-Nonanol, 8-methyl-, 1-propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1-Nonanol, 8-methyl-, 1-propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Nonanol, 8-methyl-, 1-propanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Nonanol, 8-methyl-, 1-propanoate?
The CAS number of 1-Nonanol, 8-methyl-, 1-propanoate is 67845-27-6.
What is the molecular formula of 1-Nonanol, 8-methyl-, 1-propanoate?
The molecular formula of 1-Nonanol, 8-methyl-, 1-propanoate is C13H26O2.
What is the molecular weight of 1-Nonanol, 8-methyl-, 1-propanoate?
The molecular weight of 1-Nonanol, 8-methyl-, 1-propanoate is 214.19328 g/mol.
Where can I buy 1-Nonanol, 8-methyl-, 1-propanoate?
You can request a quote for 1-Nonanol, 8-methyl-, 1-propanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Nonanol, 8-methyl-, 1-propanoate?
Yes, CoreyChem provides custom synthesis services for 1-Nonanol, 8-methyl-, 1-propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.