Isobutyl pentyl disulfide
TL;DR: Isobutyl pentyl disulfide (CAS 75203-63-3) 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-(2-methylpropyldisulfanyl)pentane
Also Known As: Isobutyl pentyl disulfide, Isobutylpentyl persulfide, 2-methylpropyl pentyl disulfide, 1-(Isobutyldisulfanyl)pentane #, 1-(2-methylpropyldisulfanyl)pentane
| Molecular Formula | C9H20S2 |
|---|---|
| Molecular Weight | 192.10 g/mol |
| LogP | 4.0 |
| 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 | 75203-63-3 |
|---|---|
| SMILES | CCCCCSSCC(C)C |
| InChIKey | NUSPJQCFQICJTH-UHFFFAOYSA-N |
Product Overview
Isobutyl pentyl disulfide (CAS 75203-63-3), with molecular formula C9H20S2 and molecular weight 192.10 g/mol. IUPAC: 1-(2-methylpropyldisulfanyl)pentane.
Chemical Property Profile of Isobutyl pentyl disulfide
Property Insights of Isobutyl pentyl disulfide
The XLogP value of 4.0 indicates that Isobutyl pentyl disulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, Isobutyl pentyl disulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isobutyl pentyl disulfide 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 Isobutyl pentyl disulfide?
The CAS number of Isobutyl pentyl disulfide is 75203-63-3.
What is the molecular formula of Isobutyl pentyl disulfide?
The molecular formula of Isobutyl pentyl disulfide is C9H20S2.
What is the molecular weight of Isobutyl pentyl disulfide?
The molecular weight of Isobutyl pentyl disulfide is 192.10 g/mol.
Where can I buy Isobutyl pentyl disulfide?
You can request a quote for Isobutyl pentyl disulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isobutyl pentyl disulfide?
Yes, KEHONG BIO provides custom synthesis services for Isobutyl pentyl disulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.