(2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate
TL;DR: (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate (CAS 85586-69-2) is a chemical compound with molecular formula C27H38O5S and molecular weight 474.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-1,2-diphenylethoxy)methyl dodecane-1-sulfonate
Also Known As: methyldodecane-1-sulphonate, EINECS 287-874-9, (2-oxo-1,2-diphenylethoxy)methyl dodecane-1-sulfonate, (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate, 1-Dodecanesulfonic acid (2-oxo-1,2-diphenylethoxy)methyl ester
| Molecular Formula | C27H38O5S |
|---|---|
| Molecular Weight | 474.24 g/mol |
| LogP | 6.852 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 18 |
| Exact Mass | 474.244 |
| Heavy Atoms | 33 |
| Complexity | 881.24243 |
Chemical Identifiers
| CAS Number | 85586-69-2 |
|---|---|
| SMILES | CCCCCCCCCCCCS(=O)(=O)OCOC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2 |
Product Overview
(2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate (CAS 85586-69-2), with molecular formula C27H38O5S and molecular weight 474.24 g/mol. IUPAC: (2-oxo-1,2-diphenylethoxy)methyl dodecane-1-sulfonate.
Chemical Property Profile of (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate
Property Insights of (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate
The XLogP value of 6.852 indicates that (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate. Following Lipinski's Rule of Five, (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate?
The CAS number of (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate is 85586-69-2.
What is the molecular formula of (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate?
The molecular formula of (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate is C27H38O5S.
What is the molecular weight of (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate?
The molecular weight of (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate is 474.24 g/mol.
Where can I buy (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate?
You can request a quote for (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate?
Yes, KEHONG BIO provides custom synthesis services for (2-Oxo-1,2-diphenylethoxy)methyl dodecane-1-sulphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.