RefChem:91683
TL;DR: RefChem:91683 (CAS 66172-79-0) is a chemical compound with molecular formula C54H95O16P and molecular weight 1030.64 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[2-[2-[2-[2-[2-[2-(2-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl] hydrogen phosphate
Also Known As: Di(nonylphenol hexa(oxyethylene))hydrogen phosphate, 3,6,9,12,15-Pentaoxaheptadecan-1-ol, 17-(nonylphenoxy)-, hydrogen phosphate, 3,6,9,12,15-Pentaoxaheptadecan-1-ol, 17-(nonylphenoxy)-, 1,1'-(hydrogen phosphate), bis[17-(2-nonylphenoxy)-3,6,9,12,15-pentaoxaheptadec-1-yl] hydrogen phosphate, bis[17-(Nonylphenoxy)-3,6,9,12,15-pentaoxaheptadecan-1-yl] hydrogen phosphate
| Molecular Formula | C54H95O16P |
|---|---|
| Molecular Weight | 1030.64 g/mol |
| LogP | 10.0 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 56 |
| Exact Mass | 1030.6357 |
| Heavy Atoms | 71 |
| Complexity | 1050.0 |
Chemical Identifiers
| CAS Number | 66172-79-0 |
|---|---|
| SMILES | CCCCCCCCCC1=CC=CC=C1OCCOCCOCCOCCOCCOCCOP(=O)(O)OCCOCCOCCOCCOCCOCCOC2=CC=CC=C2CCCCCCCCC |
| InChIKey | CXJNUUJXSIVKDP-UHFFFAOYSA-N |
Product Overview
RefChem:91683 (CAS 66172-79-0), with molecular formula C54H95O16P and molecular weight 1030.64 g/mol. IUPAC: bis[2-[2-[2-[2-[2-[2-(2-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl] hydrogen phosphate.
Chemical Property Profile of RefChem:91683
Property Insights of RefChem:91683
The XLogP value of 10.0 indicates that RefChem:91683 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 167.0 Ų indicates high polarity, suggesting RefChem:91683 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:91683 has 1 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:91683?
The CAS number of RefChem:91683 is 66172-79-0.
What is the molecular formula of RefChem:91683?
The molecular formula of RefChem:91683 is C54H95O16P.
What is the molecular weight of RefChem:91683?
The molecular weight of RefChem:91683 is 1030.64 g/mol.
Where can I buy RefChem:91683?
You can request a quote for RefChem:91683 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:91683?
Yes, KEHONG BIO provides custom synthesis services for RefChem:91683 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.