RefChem:91672
TL;DR: RefChem:91672 (CAS 66172-78-9) is a chemical compound with molecular formula C38H71O11P and molecular weight 734.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[2-[2-[2-[2-[2-[2,6-di(nonyl)phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl dihydrogen phosphate
Also Known As: Nonyl nonoxynol-7 phosphate, (Dinonylphenol hepta(oxyethylene))dihydrogen phosphate, 3,6,9,12,15,18-Hexaoxaeicosan-1-ol, 20-(dinonylphenoxy)-, dihydrogen phosphate, 3,6,9,12,15,18-Hexaoxaeicosan-1-ol, 20-(dinonylphenoxy)-, 1-(dihydrogen phosphate), 1H-Purine-2,6-dione,3,7-dihydro-1,8-dimethyl-3-(2-methylbutyl)
| Molecular Formula | C38H71O11P |
|---|---|
| Molecular Weight | 734.47 g/mol |
| LogP | 8.4 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 39 |
| Exact Mass | 734.4734 |
| Heavy Atoms | 50 |
| Complexity | 716.0 |
Chemical Identifiers
| CAS Number | 66172-78-9 |
|---|---|
| SMILES | CCCCCCCCCC1=C(C(=CC=C1)CCCCCCCCC)OCCOCCOCCOCCOCCOCCOCCOP(=O)(O)O |
| InChIKey | YXRORYCCMLOKDX-UHFFFAOYSA-N |
Product Overview
RefChem:91672 (CAS 66172-78-9), with molecular formula C38H71O11P and molecular weight 734.47 g/mol. IUPAC: 2-[2-[2-[2-[2-[2-[2-[2,6-di(nonyl)phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl dihydrogen phosphate.
Chemical Property Profile of RefChem:91672
Property Insights of RefChem:91672
The XLogP value of 8.4 indicates that RefChem:91672 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:91672. Following Lipinski's Rule of Five, RefChem:91672 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:91672?
The CAS number of RefChem:91672 is 66172-78-9.
What is the molecular formula of RefChem:91672?
The molecular formula of RefChem:91672 is C38H71O11P.
What is the molecular weight of RefChem:91672?
The molecular weight of RefChem:91672 is 734.47 g/mol.
Where can I buy RefChem:91672?
You can request a quote for RefChem:91672 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:91672?
Yes, KEHONG BIO provides custom synthesis services for RefChem:91672 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.