1-Propyl-2,4,6,8,9,10-hexathiaadamantane
TL;DR: 1-Propyl-2,4,6,8,9,10-hexathiaadamantane (CAS 57274-29-0) is a chemical compound with molecular formula C7H10S6 and molecular weight 285.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propyl-2,4,6,8,9,10-hexathiatricyclo[3.3.1.13,7]decane
Also Known As: 1-Propyl-2,4,6,8,9,10-hexathiaadamantane, 2,4,6,8,9,10-Hexathiatricyclo[3.3.1.1(3,7)]decane, 1-propyl-, 2,4,6,8,9,10-Hexathiatricyclo[3.3.1.13,7]decane, 1-propyl-, (3s)-1-propyl-2,4,6,8,9,10-hexathiatricyclo[3.3.1.13,7]decane
| Molecular Formula | C7H10S6 |
|---|---|
| Molecular Weight | 285.91 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.91068 |
| Heavy Atoms | 13 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 57274-29-0 |
|---|---|
| SMILES | CCCC12SC3SC(S1)SC(S3)S2 |
| InChIKey | HBQFKGSQEVFTAT-UHFFFAOYSA-N |
Product Overview
1-Propyl-2,4,6,8,9,10-hexathiaadamantane (CAS 57274-29-0), with molecular formula C7H10S6 and molecular weight 285.91 g/mol. IUPAC: 1-propyl-2,4,6,8,9,10-hexathiatricyclo[3.3.1.13,7]decane.
Chemical Property Profile of 1-Propyl-2,4,6,8,9,10-hexathiaadamantane
Property Insights of 1-Propyl-2,4,6,8,9,10-hexathiaadamantane
The XLogP value of 5.6 indicates that 1-Propyl-2,4,6,8,9,10-hexathiaadamantane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 152.0 Ų indicates high polarity, suggesting 1-Propyl-2,4,6,8,9,10-hexathiaadamantane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Propyl-2,4,6,8,9,10-hexathiaadamantane has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Propyl-2,4,6,8,9,10-hexathiaadamantane?
The CAS number of 1-Propyl-2,4,6,8,9,10-hexathiaadamantane is 57274-29-0.
What is the molecular formula of 1-Propyl-2,4,6,8,9,10-hexathiaadamantane?
The molecular formula of 1-Propyl-2,4,6,8,9,10-hexathiaadamantane is C7H10S6.
What is the molecular weight of 1-Propyl-2,4,6,8,9,10-hexathiaadamantane?
The molecular weight of 1-Propyl-2,4,6,8,9,10-hexathiaadamantane is 285.91 g/mol.
Where can I buy 1-Propyl-2,4,6,8,9,10-hexathiaadamantane?
You can request a quote for 1-Propyl-2,4,6,8,9,10-hexathiaadamantane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propyl-2,4,6,8,9,10-hexathiaadamantane?
Yes, KEHONG BIO provides custom synthesis services for 1-Propyl-2,4,6,8,9,10-hexathiaadamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.