RefChem:173795
TL;DR: RefChem:173795 (CAS 68110-44-1) is a chemical compound with molecular formula C20H49N2O10P and molecular weight 508.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-[bis(2-hydroxyethyl)amino]ethanol);6-methylheptyl dihydrogen phosphate
Also Known As: Phosphoric acid, isooctyl ester, ditriethanolamine salt, Disodium 4,4'-methylenebis(3-hydroxy-2-naphthoate), Phosphoric acid, monoisooctyl ester, compd. with 2,2',2''-nitrilotris[ethanol] (1:2), 6-methylheptyl dihydrogen phosphate- 2,2',2''-nitrilotriethanol(1:2), Phosphoric acid, monoisooctyl ester, compd. with 2,2',2''-nitrilotris(ethanol) (1:2)
| Molecular Formula | C20H49N2O10P |
|---|---|
| Molecular Weight | 508.31 g/mol |
| LogP | -1.16 |
| Topological Polar Surface Area | 195.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 19 |
| Exact Mass | 508.31247 |
| Heavy Atoms | 33 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 68110-44-1 |
|---|---|
| SMILES | CC(C)CCCCCOP(=O)(O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO |
| InChIKey | IHQNGCACOHJPMW-UHFFFAOYSA-N |
Product Overview
RefChem:173795 (CAS 68110-44-1), with molecular formula C20H49N2O10P and molecular weight 508.31 g/mol. IUPAC: bis(2-[bis(2-hydroxyethyl)amino]ethanol);6-methylheptyl dihydrogen phosphate.
Chemical Property Profile of RefChem:173795
Property Insights of RefChem:173795
The XLogP value of -1.16 indicates that RefChem:173795 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 195.0 Ų indicates high polarity, suggesting RefChem:173795 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:173795 has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:173795?
The CAS number of RefChem:173795 is 68110-44-1.
What is the molecular formula of RefChem:173795?
The molecular formula of RefChem:173795 is C20H49N2O10P.
What is the molecular weight of RefChem:173795?
The molecular weight of RefChem:173795 is 508.31 g/mol.
Where can I buy RefChem:173795?
You can request a quote for RefChem:173795 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:173795?
Yes, KEHONG BIO provides custom synthesis services for RefChem:173795 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.