2-(Isocyanomethyl)-5-methylfuran
TL;DR: 2-(Isocyanomethyl)-5-methylfuran (CAS 1031256-45-7) is a chemical compound with molecular formula C7H7NO and molecular weight 121.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(isocyanomethyl)-5-methylfuran
Also Known As: 2-(isocyanomethyl)-5-methylfuran, 2-Methylfurfurylisocyanide, TOS-BB-0792, 2-(isocyanomethyl)-5-methyl-furan
| Molecular Formula | C7H7NO |
|---|---|
| Molecular Weight | 121.05 g/mol |
| LogP | 2.00731 |
| Topological Polar Surface Area | 17.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 121.052765 |
| Heavy Atoms | 9 |
| Complexity | 231.30934 |
Chemical Identifiers
| CAS Number | 1031256-45-7 |
|---|---|
| SMILES | CC1=CC=C(O1)C[N+]#[C-] |
Product Overview
2-(Isocyanomethyl)-5-methylfuran (CAS 1031256-45-7), with molecular formula C7H7NO and molecular weight 121.05 g/mol. IUPAC: 2-(isocyanomethyl)-5-methylfuran.
Chemical Property Profile of 2-(Isocyanomethyl)-5-methylfuran
Property Insights of 2-(Isocyanomethyl)-5-methylfuran
The XLogP value of 2.00731 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Isocyanomethyl)-5-methylfuran. With a topological polar surface area (TPSA) of 17.5 Ų, 2-(Isocyanomethyl)-5-methylfuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Isocyanomethyl)-5-methylfuran has 0 hydrogen bond donor(s) and 1 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 2-(Isocyanomethyl)-5-methylfuran?
The CAS number of 2-(Isocyanomethyl)-5-methylfuran is 1031256-45-7.
What is the molecular formula of 2-(Isocyanomethyl)-5-methylfuran?
The molecular formula of 2-(Isocyanomethyl)-5-methylfuran is C7H7NO.
What is the molecular weight of 2-(Isocyanomethyl)-5-methylfuran?
The molecular weight of 2-(Isocyanomethyl)-5-methylfuran is 121.05 g/mol.
Where can I buy 2-(Isocyanomethyl)-5-methylfuran?
You can request a quote for 2-(Isocyanomethyl)-5-methylfuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Isocyanomethyl)-5-methylfuran?
Yes, KEHONG BIO provides custom synthesis services for 2-(Isocyanomethyl)-5-methylfuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.