RefChem:1067670
TL;DR: RefChem:1067670 (CAS 67635-58-9) is a chemical compound with molecular formula C31H57NO4S and molecular weight 539.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazanium;decane-1-sulfonate
Also Known As: (3-Cyclohexyl-3-hydroxy-3-phenylpropyl)triethylammonium decanesulfonate, AMMONIUM, (3-CYCLOHEXYL-3-HYDROXY-3-PHENYLPROPYL)TRIETHYL-, DECANESULFONATE, (3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazanium;decane-1-sulfonate, 3-Cyclohexyl-N,N,N-triethyl-3-hydroxy-3-phenylpropan-1-aminium decane-1-sulfonate, (3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazanium; decane-1-sulfonate
| Molecular Formula | C31H57NO4S |
|---|---|
| Molecular Weight | 539.40 g/mol |
| LogP | 7.39 |
| Topological Polar Surface Area | 85.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 539.4008 |
| Heavy Atoms | 37 |
| Complexity | 509.0 |
Chemical Identifiers
| CAS Number | 67635-58-9 |
|---|---|
| SMILES | CCCCCCCCCCS(=O)(=O)[O-].CC[N+](CC)(CC)CCC(C1CCCCC1)(C2=CC=CC=C2)O |
| InChIKey | GZUXZYHWDXTURB-UHFFFAOYSA-M |
Product Overview
RefChem:1067670 (CAS 67635-58-9), with molecular formula C31H57NO4S and molecular weight 539.40 g/mol. IUPAC: (3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazanium;decane-1-sulfonate.
Chemical Property Profile of RefChem:1067670
Property Insights of RefChem:1067670
The XLogP value of 7.39 indicates that RefChem:1067670 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1067670. Following Lipinski's Rule of Five, RefChem:1067670 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1067670?
The CAS number of RefChem:1067670 is 67635-58-9.
What is the molecular formula of RefChem:1067670?
The molecular formula of RefChem:1067670 is C31H57NO4S.
What is the molecular weight of RefChem:1067670?
The molecular weight of RefChem:1067670 is 539.40 g/mol.
Where can I buy RefChem:1067670?
You can request a quote for RefChem:1067670 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1067670?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1067670 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.