Monoisononyl phthalate
TL;DR: Monoisononyl phthalate (CAS 106610-61-1) is a chemical compound with molecular formula C17H24O4 and molecular weight 292.16745 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(7-methyloctoxycarbonyl)benzoic acid
Also Known As: monoisononyl phthalate, isononyl phthalate, monoisononylphthalate, mono-isononyl phthalate, starbld0018826
Technical Specifications
| Molecular Formula | C17H24O4 |
| Molecular Weight | 292.16745 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 292.16745 Da |
| Heavy Atoms | 21 |
| Complexity | 325.0 |
| SMILES | CC(C)CCCCCCOC(=O)C1=CC=CC=C1C(=O)O |
| InChIKey | RNCMBSSLYOAVRT-UHFFFAOYSA-N |
Chemical Property Profile of Monoisononyl phthalate
Property Insights of Monoisononyl phthalate
The XLogP value of 5.6 indicates that Monoisononyl phthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Monoisononyl phthalate. Following Lipinski's Rule of Five, Monoisononyl phthalate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Monoisononyl phthalate?
The CAS number of Monoisononyl phthalate is 106610-61-1.
What is the molecular formula of Monoisononyl phthalate?
The molecular formula of Monoisononyl phthalate is C17H24O4.
What is the molecular weight of Monoisononyl phthalate?
The molecular weight of Monoisononyl phthalate is 292.16745 g/mol.
Where can I buy Monoisononyl phthalate?
You can request a quote for Monoisononyl phthalate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Monoisononyl phthalate?
Yes, CoreyChem provides custom synthesis services for Monoisononyl phthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.