2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester
TL;DR: 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester (CAS 6927-30-6) is a chemical compound with molecular formula C20H34O3S2 and molecular weight 386.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 2-dodecylsulfanylethanesulfonate
Also Known As: phenyl 2-dodecylsulfanylethanesulfonate, 1-(2-phenoxysulfonylethylsulfanyl)dodecane, 2-DODECYLSULFANYL-ETHANESULFONIC ACID PHENYL ESTER
| Molecular Formula | C20H34O3S2 |
|---|---|
| Molecular Weight | 386.19 g/mol |
| LogP | 6.0493 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 386.19495 |
| Heavy Atoms | 25 |
| Complexity | 515.0026 |
Chemical Identifiers
| CAS Number | 6927-30-6 |
|---|---|
| SMILES | CCCCCCCCCCCCSCCS(=O)(=O)OC1=CC=CC=C1 |
Product Overview
2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester (CAS 6927-30-6), with molecular formula C20H34O3S2 and molecular weight 386.19 g/mol. IUPAC: phenyl 2-dodecylsulfanylethanesulfonate.
Chemical Property Profile of 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester
Property Insights of 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester
The XLogP value of 6.0493 indicates that 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester has 0 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 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester?
The CAS number of 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester is 6927-30-6.
What is the molecular formula of 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester?
The molecular formula of 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester is C20H34O3S2.
What is the molecular weight of 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester?
The molecular weight of 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester is 386.19 g/mol.
Where can I buy 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester?
You can request a quote for 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Dodecylsulfanyl-ethanesulfonic acid phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.