Di-tert-butylnonasulfane
TL;DR: Di-tert-butylnonasulfane (CAS 7330-36-1) is a chemical compound with molecular formula C8H18S9 and molecular weight 401.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(tert-butylnonasulfanyl)-2-methylpropane
Also Known As: di-tert-butylnonasulfane, tert-Butyl nonasulphide, Di-tert-butyl pernonasulfide, TERT-BUTYL NONASULFIDE, Bis(2-methyl-2-propanyl)nonasulfane
| Molecular Formula | C8H18S9 |
|---|---|
| Molecular Weight | 401.89 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 228.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 401.8895 |
| Heavy Atoms | 17 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 7330-36-1 |
|---|---|
| SMILES | CC(C)(C)SSSSSSSSSC(C)(C)C |
| InChIKey | JHMFXPJTIFMCGZ-UHFFFAOYSA-N |
Product Overview
Di-tert-butylnonasulfane (CAS 7330-36-1), with molecular formula C8H18S9 and molecular weight 401.89 g/mol. IUPAC: 2-(tert-butylnonasulfanyl)-2-methylpropane.
Chemical Property Profile of Di-tert-butylnonasulfane
Property Insights of Di-tert-butylnonasulfane
The XLogP value of 6.0 indicates that Di-tert-butylnonasulfane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 228.0 Ų indicates high polarity, suggesting Di-tert-butylnonasulfane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Di-tert-butylnonasulfane has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Di-tert-butylnonasulfane?
The CAS number of Di-tert-butylnonasulfane is 7330-36-1.
What is the molecular formula of Di-tert-butylnonasulfane?
The molecular formula of Di-tert-butylnonasulfane is C8H18S9.
What is the molecular weight of Di-tert-butylnonasulfane?
The molecular weight of Di-tert-butylnonasulfane is 401.89 g/mol.
Where can I buy Di-tert-butylnonasulfane?
You can request a quote for Di-tert-butylnonasulfane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di-tert-butylnonasulfane?
Yes, KEHONG BIO provides custom synthesis services for Di-tert-butylnonasulfane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.