RefChem:167640
TL;DR: RefChem:167640 (CAS 68170-60-5) is a chemical compound with molecular formula C22H47NO8S and molecular weight 485.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-hydroxyethylamino)ethanol;9-sulfooxyoctadecanoic acid
Also Known As: Diethanolamine salt of sulfated oleic acid, 9(or 10)-(Sulfooxy)stearic acid diethanolamine salt, 9-(sulfooxy)octadecanoic acid- 2,2'-iminodiethanol(1:1), 2-(2-hydroxyethylamino)ethanol; 9-sulfooxyoctadecanoic acid, Octadecanoic acid, 9(or 10)-(sulfooxy)-, compd. with 2,2'-iminobis(ethanol)
| Molecular Formula | C22H47NO8S |
|---|---|
| Molecular Weight | 485.30 g/mol |
| LogP | 3.69 |
| Topological Polar Surface Area | 162.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 22 |
| Exact Mass | 485.30225 |
| Heavy Atoms | 32 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 68170-60-5 |
|---|---|
| SMILES | CCCCCCCCCC(CCCCCCCC(=O)O)OS(=O)(=O)O.C(CO)NCCO |
| InChIKey | MUONFKYENDVFQV-UHFFFAOYSA-N |
Product Overview
RefChem:167640 (CAS 68170-60-5), with molecular formula C22H47NO8S and molecular weight 485.30 g/mol. IUPAC: 2-(2-hydroxyethylamino)ethanol;9-sulfooxyoctadecanoic acid.
Chemical Property Profile of RefChem:167640
Property Insights of RefChem:167640
The XLogP value of 3.69 indicates that RefChem:167640 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 162.0 Ų indicates high polarity, suggesting RefChem:167640 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:167640 has 5 hydrogen bond donor(s) and 9 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 RefChem:167640?
The CAS number of RefChem:167640 is 68170-60-5.
What is the molecular formula of RefChem:167640?
The molecular formula of RefChem:167640 is C22H47NO8S.
What is the molecular weight of RefChem:167640?
The molecular weight of RefChem:167640 is 485.30 g/mol.
Where can I buy RefChem:167640?
You can request a quote for RefChem:167640 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:167640?
Yes, KEHONG BIO provides custom synthesis services for RefChem:167640 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.