2,3-Bis(acetylsulfanyl)propyl acetate
TL;DR: 2,3-Bis(acetylsulfanyl)propyl acetate (CAS 59051-15-9) is a chemical compound with molecular formula C9H14O4S2 and molecular weight 250.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-bis(acetylsulfanyl)propyl acetate
Also Known As: Thiol esters, Triacetyl dimercaprol, 2,3-bis(acetylsulfanyl)propyl acetate, 2,3-Diacetylthiopropyl acetate, NIOSH/AJ7320000
| Molecular Formula | C9H14O4S2 |
|---|---|
| Molecular Weight | 250.03 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 250.03336 |
| Heavy Atoms | 15 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 59051-15-9 |
|---|---|
| SMILES | CC(=O)OCC(CSC(=O)C)SC(=O)C |
| InChIKey | MPXDRBQHZCUXHZ-UHFFFAOYSA-N |
Product Overview
2,3-Bis(acetylsulfanyl)propyl acetate (CAS 59051-15-9), with molecular formula C9H14O4S2 and molecular weight 250.03 g/mol. IUPAC: 2,3-bis(acetylsulfanyl)propyl acetate.
Chemical Property Profile of 2,3-Bis(acetylsulfanyl)propyl acetate
Property Insights of 2,3-Bis(acetylsulfanyl)propyl acetate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Bis(acetylsulfanyl)propyl acetate. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Bis(acetylsulfanyl)propyl acetate. Following Lipinski's Rule of Five, 2,3-Bis(acetylsulfanyl)propyl acetate has 0 hydrogen bond donor(s) and 6 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 2,3-Bis(acetylsulfanyl)propyl acetate?
The CAS number of 2,3-Bis(acetylsulfanyl)propyl acetate is 59051-15-9.
What is the molecular formula of 2,3-Bis(acetylsulfanyl)propyl acetate?
The molecular formula of 2,3-Bis(acetylsulfanyl)propyl acetate is C9H14O4S2.
What is the molecular weight of 2,3-Bis(acetylsulfanyl)propyl acetate?
The molecular weight of 2,3-Bis(acetylsulfanyl)propyl acetate is 250.03 g/mol.
Where can I buy 2,3-Bis(acetylsulfanyl)propyl acetate?
You can request a quote for 2,3-Bis(acetylsulfanyl)propyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Bis(acetylsulfanyl)propyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Bis(acetylsulfanyl)propyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.