![2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid structure](/static/products/6817/68171-60-8.webp)
2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid
TL;DR: 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid (CAS 68171-60-8) is a chemical compound with molecular formula C14H27N2O3+ and molecular weight 271.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid
Also Known As: 2-[2-heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-yl]acetic Acid, 1-(Carboxylatomethyl)-2-heptyl-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium, 1H-Imidazolium, 1-(carboxymethyl)-2-heptyl-4,5-dihydro-1-(2-hydroxyethyl)-, inner salt, 2-[2-heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid, 1H-Imidazolium, 1-(carboxymethyl)-2-heptyl-4,5-dihydro-1-(2-hydroxyethyl)-, hydroxide, inner salt
| Molecular Formula | C14H27N2O3+ |
|---|---|
| Molecular Weight | 271.20 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 271.20218 |
| Heavy Atoms | 19 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 68171-60-8 |
|---|---|
| SMILES | CCCCCCCC1=NCC[N+]1(CCO)CC(=O)O |
| InChIKey | IGYYYMBAPCNKSD-UHFFFAOYSA-O |
Product Overview
2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid (CAS 68171-60-8), with molecular formula C14H27N2O3+ and molecular weight 271.20 g/mol. IUPAC: 2-[2-heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid.
Chemical Property Profile of 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid
Property Insights of 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid. Following Lipinski's Rule of Five, 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid has 2 hydrogen bond donor(s) and 4 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 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid?
The CAS number of 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid is 68171-60-8.
What is the molecular formula of 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid?
The molecular formula of 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid is C14H27N2O3+.
What is the molecular weight of 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid?
The molecular weight of 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid is 271.20 g/mol.
Where can I buy 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid?
You can request a quote for 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-Heptyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.