2-Heptyl-2-(hydroxymethyl)decanoic acid
TL;DR: 2-Heptyl-2-(hydroxymethyl)decanoic acid (CAS 58243-91-7) is a chemical compound with molecular formula C18H36O3 and molecular weight 300.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-heptyl-2-(hydroxymethyl)decanoic acid
Also Known As: 2-heptyl-2-(hydroxymethyl)decanoic acid
| Molecular Formula | C18H36O3 |
|---|---|
| Molecular Weight | 300.27 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 300.26645 |
| Heavy Atoms | 21 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 58243-91-7 |
|---|---|
| SMILES | CCCCCCCCC(CCCCCCC)(CO)C(=O)O |
| InChIKey | CGWXOPHSWXSPLL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Heptyl-2-(hydroxymethyl)decanoic acid (CAS 58243-91-7), with molecular formula C18H36O3 and molecular weight 300.27 g/mol. IUPAC: 2-heptyl-2-(hydroxymethyl)decanoic acid.
Chemical Property Profile of 2-Heptyl-2-(hydroxymethyl)decanoic acid
Property Insights of 2-Heptyl-2-(hydroxymethyl)decanoic acid
The XLogP value of 6.6 indicates that 2-Heptyl-2-(hydroxymethyl)decanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 2-Heptyl-2-(hydroxymethyl)decanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Heptyl-2-(hydroxymethyl)decanoic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Heptyl-2-(hydroxymethyl)decanoic acid?
The CAS number of 2-Heptyl-2-(hydroxymethyl)decanoic acid is 58243-91-7.
What is the molecular formula of 2-Heptyl-2-(hydroxymethyl)decanoic acid?
The molecular formula of 2-Heptyl-2-(hydroxymethyl)decanoic acid is C18H36O3.
What is the molecular weight of 2-Heptyl-2-(hydroxymethyl)decanoic acid?
The molecular weight of 2-Heptyl-2-(hydroxymethyl)decanoic acid is 300.27 g/mol.
Where can I buy 2-Heptyl-2-(hydroxymethyl)decanoic acid?
You can request a quote for 2-Heptyl-2-(hydroxymethyl)decanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Heptyl-2-(hydroxymethyl)decanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Heptyl-2-(hydroxymethyl)decanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.