RefChem:438467
TL;DR: RefChem:438467 (CAS 67892-37-9) is a chemical compound with molecular formula C25H46N2O3 and molecular weight 422.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-heptadec-8-enyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]propanoate
Also Known As: 1H-Imidazolium, 1-(2-carboxyethyl)-2-(8-heptadecenyl)-4,5-dihydro-1-(2-hydroxyethyl)-, inner salt, 3-[2-heptadec-8-enyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]propanoate, 1-(2-Carboxylatoethyl)-2-(heptadec-8-enyl)-4,5-dihydro-1-(2-hydroxyethyl)-1H-imidazolium, 1H-Imidazolium, 1-(2-carboxyethyl)-2-(8-heptadecenyl) -4,5-dihydro-1-(2-hydroxyethyl)-, hydroxide, inner salt, 1H-Imidazolium, 1-(2-carboxyethyl)-2-(8-heptadecenyl)-4,5-dihydro-1-(2-hydroxyeth- yl)-, hydroxide, inner salt
| Molecular Formula | C25H46N2O3 |
|---|---|
| Molecular Weight | 422.35 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 19 |
| Exact Mass | 422.35083 |
| Heavy Atoms | 30 |
| Complexity | 499.0 |
Chemical Identifiers
| CAS Number | 67892-37-9 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC1=NCC[N+]1(CCC(=O)[O-])CCO |
| InChIKey | HZQUHSAZKBXDKE-UHFFFAOYSA-N |
Product Overview
RefChem:438467 (CAS 67892-37-9), with molecular formula C25H46N2O3 and molecular weight 422.35 g/mol. IUPAC: 3-[2-heptadec-8-enyl-1-(2-hydroxyethyl)-4,5-dihydroimidazol-1-ium-1-yl]propanoate.
Chemical Property Profile of RefChem:438467
Property Insights of RefChem:438467
The XLogP value of 6.7 indicates that RefChem:438467 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:438467. Following Lipinski's Rule of Five, RefChem:438467 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:438467?
The CAS number of RefChem:438467 is 67892-37-9.
What is the molecular formula of RefChem:438467?
The molecular formula of RefChem:438467 is C25H46N2O3.
What is the molecular weight of RefChem:438467?
The molecular weight of RefChem:438467 is 422.35 g/mol.
Where can I buy RefChem:438467?
You can request a quote for RefChem:438467 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:438467?
Yes, KEHONG BIO provides custom synthesis services for RefChem:438467 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.