2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid
TL;DR: 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid (CAS 68648-94-2) is a chemical compound with molecular formula C26H46O6 and molecular weight 454.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid
Also Known As: 2-ethylhexan-1-ol; 8-methylnonan-1-ol; phthalic acid, 1,2-Benzenedicarboxylic acid, mixed 2-ethylhexyl and hexyl and isodecyl diesters
| Molecular Formula | C26H46O6 |
|---|---|
| Molecular Weight | 454.33 g/mol |
| LogP | 6.25 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 454.32944 |
| Heavy Atoms | 32 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 68648-94-2 |
|---|---|
| SMILES | CCCCC(CC)CO.CC(C)CCCCCCCO.C1=CC=C(C(=C1)C(=O)O)C(=O)O |
| InChIKey | XPNJETNPNBXRQK-UHFFFAOYSA-N |
Product Overview
2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid (CAS 68648-94-2), with molecular formula C26H46O6 and molecular weight 454.33 g/mol. IUPAC: 2-ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid.
Chemical Property Profile of 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid
Property Insights of 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid
The XLogP value of 6.25 indicates that 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid. Following Lipinski's Rule of Five, 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid?
The CAS number of 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid is 68648-94-2.
What is the molecular formula of 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid?
The molecular formula of 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid is C26H46O6.
What is the molecular weight of 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid?
The molecular weight of 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid is 454.33 g/mol.
Where can I buy 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid?
You can request a quote for 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylhexan-1-ol;8-methylnonan-1-ol;phthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.