Diamyl Sulfite
TL;DR: Diamyl Sulfite (CAS 2051-05-0) is a chemical compound with molecular formula CCCCCOS(=O)OCCCCC and molecular weight 222.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipentyl sulfite
Also Known As: Diamyl Sulfite, Dipentyl sulfite, Pentyl sulfite, DIAMYLSULFITE, Sulfurous acid, dipentyl ester
| Molecular Formula | CCCCCOS(=O)OCCCCC |
|---|---|
| Molecular Weight | 222.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 222.12897 |
| Heavy Atoms | 14 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 2051-05-0 |
|---|---|
| SMILES | CCCCCOS(=O)OCCCCC |
| InChIKey | QHKKGWHSXSIVAJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diamyl Sulfite (CAS 2051-05-0), with molecular formula CCCCCOS(=O)OCCCCC and molecular weight 222.13 g/mol. IUPAC: dipentyl sulfite.
Chemical Property Profile of Diamyl Sulfite
Property Insights of Diamyl Sulfite
The XLogP value of 3.8 indicates that Diamyl Sulfite is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.7 Ų, Diamyl Sulfite exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diamyl Sulfite has 0 hydrogen bond donor(s) and 4 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 Diamyl Sulfite?
The CAS number of Diamyl Sulfite is 2051-05-0.
What is the molecular formula of Diamyl Sulfite?
The molecular formula of Diamyl Sulfite is CCCCCOS(=O)OCCCCC.
What is the molecular weight of Diamyl Sulfite?
The molecular weight of Diamyl Sulfite is 222.13 g/mol.
Where can I buy Diamyl Sulfite?
You can request a quote for Diamyl Sulfite directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diamyl Sulfite?
Yes, KEHONG BIO provides custom synthesis services for Diamyl Sulfite and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.