3-(Perfluorononyl)-1,2-propanediol-1-phosphate
TL;DR: 3-(Perfluorononyl)-1,2-propanediol-1-phosphate (CAS 54009-74-4) is a chemical compound with molecular formula C12H8F19O5P and molecular weight 623.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-nonadecafluoro-2-hydroxydodecyl) dihydrogen phosphate
Also Known As: 3-(Perfluorononyl)-1,2-propanediol-1-phosphate, 4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Nonadecafluoro-2-hydroxydodecyl dihydrogen phosphate, RefChem:275810
| Molecular Formula | C12H8F19O5P |
|---|---|
| Molecular Weight | 623.98 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 12 |
| Exact Mass | 623.9806 |
| Heavy Atoms | 37 |
| Complexity | 862.0 |
Chemical Identifiers
| CAS Number | 54009-74-4 |
|---|---|
| SMILES | C(C(COP(=O)(O)O)O)C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | ZYHAJXYNHIBBEH-UHFFFAOYSA-N |
Product Overview
3-(Perfluorononyl)-1,2-propanediol-1-phosphate (CAS 54009-74-4), with molecular formula C12H8F19O5P and molecular weight 623.98 g/mol. IUPAC: (4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-nonadecafluoro-2-hydroxydodecyl) dihydrogen phosphate.
Chemical Property Profile of 3-(Perfluorononyl)-1,2-propanediol-1-phosphate
Property Insights of 3-(Perfluorononyl)-1,2-propanediol-1-phosphate
The XLogP value of 4.7 indicates that 3-(Perfluorononyl)-1,2-propanediol-1-phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Perfluorononyl)-1,2-propanediol-1-phosphate. Following Lipinski's Rule of Five, 3-(Perfluorononyl)-1,2-propanediol-1-phosphate has 3 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(Perfluorononyl)-1,2-propanediol-1-phosphate?
The CAS number of 3-(Perfluorononyl)-1,2-propanediol-1-phosphate is 54009-74-4.
What is the molecular formula of 3-(Perfluorononyl)-1,2-propanediol-1-phosphate?
The molecular formula of 3-(Perfluorononyl)-1,2-propanediol-1-phosphate is C12H8F19O5P.
What is the molecular weight of 3-(Perfluorononyl)-1,2-propanediol-1-phosphate?
The molecular weight of 3-(Perfluorononyl)-1,2-propanediol-1-phosphate is 623.98 g/mol.
Where can I buy 3-(Perfluorononyl)-1,2-propanediol-1-phosphate?
You can request a quote for 3-(Perfluorononyl)-1,2-propanediol-1-phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Perfluorononyl)-1,2-propanediol-1-phosphate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Perfluorononyl)-1,2-propanediol-1-phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.