Isononyl propionate
TL;DR: Isononyl propionate (CAS 65155-45-5) is a chemical compound with molecular formula C12H24O2 and molecular weight 200.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyloctyl propanoate
Also Known As: Isononyl propionate, 7-methyloctyl propanoate, isononylpropionate, ISONONYL PROPANOATE, Propanoic acid, isononyl ester
| Molecular Formula | C12H24O2 |
|---|---|
| Molecular Weight | 200.18 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 200.17763 |
| Heavy Atoms | 14 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 65155-45-5 |
|---|---|
| SMILES | CCC(=O)OCCCCCCC(C)C |
| InChIKey | KOODESFNSDRUNJ-UHFFFAOYSA-N |
Product Overview
Isononyl propionate (CAS 65155-45-5), with molecular formula C12H24O2 and molecular weight 200.18 g/mol. IUPAC: 7-methyloctyl propanoate.
Chemical Property Profile of Isononyl propionate
Property Insights of Isononyl propionate
The XLogP value of 4.3 indicates that Isononyl propionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Isononyl propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isononyl propionate 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
Frequently Asked Questions
What is the CAS number of Isononyl propionate?
The CAS number of Isononyl propionate is 65155-45-5.
What is the molecular formula of Isononyl propionate?
The molecular formula of Isononyl propionate is C12H24O2.
What is the molecular weight of Isononyl propionate?
The molecular weight of Isononyl propionate is 200.18 g/mol.
Where can I buy Isononyl propionate?
You can request a quote for Isononyl propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isononyl propionate?
Yes, KEHONG BIO provides custom synthesis services for Isononyl propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.