1,3-Bis(ethylsulfonyl)-2-propanol
TL;DR: 1,3-Bis(ethylsulfonyl)-2-propanol (CAS 5671-16-9) is a chemical compound with molecular formula C7H16O5S2 and molecular weight 244.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(ethylsulfonyl)propan-2-ol
Also Known As: 1,3-Bis(ethylsulfonyl)-2-propanol, 1,3-bis(ethylsulfonyl)propan-2-ol, KST-1B5694, 1,3-Di(ethanesulfonyl)propan-2-ol, BARBITURIC ACID,1,3-BIS(ACETOXYMETHYL)-5-ETHYL-5-PHENYL
| Molecular Formula | C7H16O5S2 |
|---|---|
| Molecular Weight | 244.04 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 244.04391 |
| Heavy Atoms | 14 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 5671-16-9 |
|---|---|
| SMILES | CCS(=O)(=O)CC(CS(=O)(=O)CC)O |
| InChIKey | UMHKYZDMGFTVBF-UHFFFAOYSA-N |
Product Overview
1,3-Bis(ethylsulfonyl)-2-propanol (CAS 5671-16-9), with molecular formula C7H16O5S2 and molecular weight 244.04 g/mol. IUPAC: 1,3-bis(ethylsulfonyl)propan-2-ol.
Chemical Property Profile of 1,3-Bis(ethylsulfonyl)-2-propanol
Property Insights of 1,3-Bis(ethylsulfonyl)-2-propanol
The XLogP value of -0.9 indicates that 1,3-Bis(ethylsulfonyl)-2-propanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Bis(ethylsulfonyl)-2-propanol. Following Lipinski's Rule of Five, 1,3-Bis(ethylsulfonyl)-2-propanol has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Bis(ethylsulfonyl)-2-propanol?
The CAS number of 1,3-Bis(ethylsulfonyl)-2-propanol is 5671-16-9.
What is the molecular formula of 1,3-Bis(ethylsulfonyl)-2-propanol?
The molecular formula of 1,3-Bis(ethylsulfonyl)-2-propanol is C7H16O5S2.
What is the molecular weight of 1,3-Bis(ethylsulfonyl)-2-propanol?
The molecular weight of 1,3-Bis(ethylsulfonyl)-2-propanol is 244.04 g/mol.
Where can I buy 1,3-Bis(ethylsulfonyl)-2-propanol?
You can request a quote for 1,3-Bis(ethylsulfonyl)-2-propanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis(ethylsulfonyl)-2-propanol?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis(ethylsulfonyl)-2-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.