Diisobutyl dixanthogen
TL;DR: Diisobutyl dixanthogen (CAS 21271-96-5) is a chemical compound with molecular formula C10H18O4S2 and molecular weight 266.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl (2-methylpropoxycarbonyldisulfanyl)formate
Also Known As: Diisobutyl dixanthogen, KST-1B1687, 1,1'-[disulfanediylbis(carbonyloxy)]bis(2-methylpropane), 2-methylpropyl 2-methylpropoxycarbonyldisulfanylformate, 2-methylpropyl (2-methylpropoxycarbonyldisulfanyl)formate
| Molecular Formula | C10H18O4S2 |
|---|---|
| Molecular Weight | 266.06 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 266.06464 |
| Heavy Atoms | 16 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 21271-96-5 |
|---|---|
| SMILES | CC(C)COC(=O)SSC(=O)OCC(C)C |
| InChIKey | DJZLBPUORSTKLV-UHFFFAOYSA-N |
Product Overview
Diisobutyl dixanthogen (CAS 21271-96-5), with molecular formula C10H18O4S2 and molecular weight 266.06 g/mol. IUPAC: 2-methylpropyl (2-methylpropoxycarbonyldisulfanyl)formate.
Chemical Property Profile of Diisobutyl dixanthogen
Property Insights of Diisobutyl dixanthogen
The XLogP value of 3.9 indicates that Diisobutyl dixanthogen is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diisobutyl dixanthogen. Following Lipinski's Rule of Five, Diisobutyl dixanthogen 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 Diisobutyl dixanthogen?
The CAS number of Diisobutyl dixanthogen is 21271-96-5.
What is the molecular formula of Diisobutyl dixanthogen?
The molecular formula of Diisobutyl dixanthogen is C10H18O4S2.
What is the molecular weight of Diisobutyl dixanthogen?
The molecular weight of Diisobutyl dixanthogen is 266.06 g/mol.
Where can I buy Diisobutyl dixanthogen?
You can request a quote for Diisobutyl dixanthogen directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diisobutyl dixanthogen?
Yes, KEHONG BIO provides custom synthesis services for Diisobutyl dixanthogen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.