n-Butyl isopentyl disulphide
TL;DR: n-Butyl isopentyl disulphide (CAS 75679-09-3) is a chemical compound with molecular formula C9H20S2 and molecular weight 192.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(butyldisulfanyl)-3-methylbutane
Also Known As: n-Butylisopentyldisulphide, Isoamyl butyl disulfide, n-Butyl isopentyl disulphide, i-Amyl n-butyl disulfide, butyl 3-methylbutyl disulfide
| Molecular Formula | C9H20S2 |
|---|---|
| Molecular Weight | 192.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 192.10065 |
| Heavy Atoms | 11 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 75679-09-3 |
|---|---|
| SMILES | CCCCSSCCC(C)C |
| InChIKey | KUZHXQJLDDECCL-UHFFFAOYSA-N |
Product Overview
n-Butyl isopentyl disulphide (CAS 75679-09-3), with molecular formula C9H20S2 and molecular weight 192.10 g/mol. IUPAC: 1-(butyldisulfanyl)-3-methylbutane.
Chemical Property Profile of n-Butyl isopentyl disulphide
Property Insights of n-Butyl isopentyl disulphide
The XLogP value of 3.8 indicates that n-Butyl isopentyl disulphide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, n-Butyl isopentyl disulphide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Butyl isopentyl disulphide has 0 hydrogen bond donor(s) and 2 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 n-Butyl isopentyl disulphide?
The CAS number of n-Butyl isopentyl disulphide is 75679-09-3.
What is the molecular formula of n-Butyl isopentyl disulphide?
The molecular formula of n-Butyl isopentyl disulphide is C9H20S2.
What is the molecular weight of n-Butyl isopentyl disulphide?
The molecular weight of n-Butyl isopentyl disulphide is 192.10 g/mol.
Where can I buy n-Butyl isopentyl disulphide?
You can request a quote for n-Butyl isopentyl disulphide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Butyl isopentyl disulphide?
Yes, KEHONG BIO provides custom synthesis services for n-Butyl isopentyl disulphide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.