2-(1-Isocyanoethyl)-5-methylfuran
TL;DR: 2-(1-Isocyanoethyl)-5-methylfuran (CAS 1041193-28-5) is a chemical compound with molecular formula C8H9NO and molecular weight 135.06842 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1-isocyanoethyl)-5-methylfuran
Also Known As: 2-(1-isocyanoethyl)-5-methylfuran, 2-(1-isocyanoethyl)-5-methyl-furan
Technical Specifications
| Molecular Formula | C8H9NO |
| Molecular Weight | 135.06842 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 17.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 135.06842 Da |
| Heavy Atoms | 10 |
| Complexity | 158.0 |
| SMILES | CC1=CC=C(O1)C(C)[N+]#[C-] |
| InChIKey | WPMPBXYSDVWSMA-UHFFFAOYSA-N |
Chemical Property Profile of 2-(1-Isocyanoethyl)-5-methylfuran
Property Insights of 2-(1-Isocyanoethyl)-5-methylfuran
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1-Isocyanoethyl)-5-methylfuran. With a topological polar surface area (TPSA) of 17.5 Ų, 2-(1-Isocyanoethyl)-5-methylfuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Isocyanoethyl)-5-methylfuran 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
What is the CAS number of 2-(1-Isocyanoethyl)-5-methylfuran?
The CAS number of 2-(1-Isocyanoethyl)-5-methylfuran is 1041193-28-5.
What is the molecular formula of 2-(1-Isocyanoethyl)-5-methylfuran?
The molecular formula of 2-(1-Isocyanoethyl)-5-methylfuran is C8H9NO.
What is the molecular weight of 2-(1-Isocyanoethyl)-5-methylfuran?
The molecular weight of 2-(1-Isocyanoethyl)-5-methylfuran is 135.06842 g/mol.
Where can I buy 2-(1-Isocyanoethyl)-5-methylfuran?
You can request a quote for 2-(1-Isocyanoethyl)-5-methylfuran directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(1-Isocyanoethyl)-5-methylfuran?
Yes, CoreyChem provides custom synthesis services for 2-(1-Isocyanoethyl)-5-methylfuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.