糠基异丙基硫醚
TL;DR: 糠基异丙基硫醚 (CAS 1883-78-9) is a chemical compound with molecular formula C8H12OS and molecular weight 156.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
糠基异丙基硫醚
2-(propan-2-ylsulfanylmethyl)furan
Also Known As: FURFURYL ISOPROPYL SULFIDE, 2-((Isopropylthio)methyl)furan, Isopropyl furfuryl sulfide, Furfurylisopropylsulfide, 2-(propan-2-ylsulfanylmethyl)furan
| Molecular Formula | C8H12OS |
|---|---|
| Molecular Weight | 156.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 38.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 156.06088 |
| Heavy Atoms | 10 |
| Complexity | 93.0 |
| Boiling Point | 79.00 to 80.00 °C. @ 12.00 mm Hg |
| Density | 1.013-1.020 (20°) |
| Solubility | Insoluble in water,soluble in organic solvents |
| Refractive Index | 1.497-1.508 |
Chemical Identifiers
| CAS Number | 1883-78-9 |
|---|---|
| SMILES | CC(C)SCC1=CC=CO1 |
| InChIKey | WCHRNAKORAINOJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
糠基异丙基硫醚 (CAS 1883-78-9), with molecular formula C8H12OS and molecular weight 156.06 g/mol. IUPAC: 2-(propan-2-ylsulfanylmethyl)furan.
Chemical Property Profile of 糠基异丙基硫醚
Property Insights of 糠基异丙基硫醚
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 糠基异丙基硫醚. With a topological polar surface area (TPSA) of 38.4 Ų, 糠基异丙基硫醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 糠基异丙基硫醚 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 糠基异丙基硫醚?
The CAS number of 糠基异丙基硫醚 is 1883-78-9.
What is the molecular formula of 糠基异丙基硫醚?
The molecular formula of 糠基异丙基硫醚 is C8H12OS.
What is the molecular weight of 糠基异丙基硫醚?
The molecular weight of 糠基异丙基硫醚 is 156.06 g/mol.
Where can I buy 糠基异丙基硫醚?
You can request a quote for 糠基异丙基硫醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 糠基异丙基硫醚?
Yes, KEHONG BIO provides custom synthesis services for 糠基异丙基硫醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.