RefChem:173773
TL;DR: RefChem:173773 (CAS 67846-41-7) is a chemical compound with molecular formula C23H52NO5P and molecular weight 453.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dibutylamino)ethanol;3-methylbutyl octyl hydrogen phosphate
Also Known As: Phosphoric acid, mono(3-methylbutyl) monooctyl ester, compd. with 2-(dibutylamino)ethanol (1:1), Phosphoric acid, 3-methylbutyl octyl ester, dibutylethanolamine salt, 2-(dibutylamino)ethanol; 3-methylbutyl octyl hydrogen phosphate, 3-Methylbutyl octyl hydrogen phosphate--2-(dibutylamino)ethan-1-ol (1/1), Isopentyl octyl hydrogen phosphate, compound with 2-(dibutylamino)ethanol (1:1)
| Molecular Formula | C23H52NO5P |
|---|---|
| Molecular Weight | 453.36 g/mol |
| LogP | 6.41 |
| Topological Polar Surface Area | 79.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 20 |
| Exact Mass | 453.3583 |
| Heavy Atoms | 30 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 67846-41-7 |
|---|---|
| SMILES | CCCCCCCCOP(=O)(O)OCCC(C)C.CCCCN(CCCC)CCO |
| InChIKey | ZXUHSVBWXVYYKE-UHFFFAOYSA-N |
Product Overview
RefChem:173773 (CAS 67846-41-7), with molecular formula C23H52NO5P and molecular weight 453.36 g/mol. IUPAC: 2-(dibutylamino)ethanol;3-methylbutyl octyl hydrogen phosphate.
Chemical Property Profile of RefChem:173773
Property Insights of RefChem:173773
The XLogP value of 6.41 indicates that RefChem:173773 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:173773. Following Lipinski's Rule of Five, RefChem:173773 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:173773?
The CAS number of RefChem:173773 is 67846-41-7.
What is the molecular formula of RefChem:173773?
The molecular formula of RefChem:173773 is C23H52NO5P.
What is the molecular weight of RefChem:173773?
The molecular weight of RefChem:173773 is 453.36 g/mol.
Where can I buy RefChem:173773?
You can request a quote for RefChem:173773 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:173773?
Yes, KEHONG BIO provides custom synthesis services for RefChem:173773 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.