2-Methyl-3(2-furyl)acrolein
TL;DR: 2-Methyl-3(2-furyl)acrolein (CAS 108576-21-2) is a chemical compound with molecular formula C8H8O2 and molecular weight 136.05243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(furan-2-yl)-2-methylprop-2-enal
Also Known As: 2-Methyl-3-(2-furyl)propenal, cinnamon acrolein, alpha-Methylfurylacrolein, Furfurylidene-2-propanal, Furfurylidine-2-propanal
Technical Specifications
| Molecular Formula | C8H8O2 |
| Molecular Weight | 136.05243 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 136.05243 Da |
| Heavy Atoms | 10 |
| Complexity | 149.0 |
| SMILES | C/C(=C\C1=CC=CO1)/C=O |
| InChIKey | ZNBXZUKDRRRQJK-FNORWQNLSA-N |
Chemical Property Profile of 2-Methyl-3(2-furyl)acrolein
Property Insights of 2-Methyl-3(2-furyl)acrolein
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-3(2-furyl)acrolein. With a topological polar surface area (TPSA) of 30.2 Ų, 2-Methyl-3(2-furyl)acrolein exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-3(2-furyl)acrolein 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-Methyl-3(2-furyl)acrolein?
The CAS number of 2-Methyl-3(2-furyl)acrolein is 108576-21-2.
What is the molecular formula of 2-Methyl-3(2-furyl)acrolein?
The molecular formula of 2-Methyl-3(2-furyl)acrolein is C8H8O2.
What is the molecular weight of 2-Methyl-3(2-furyl)acrolein?
The molecular weight of 2-Methyl-3(2-furyl)acrolein is 136.05243 g/mol.
Where can I buy 2-Methyl-3(2-furyl)acrolein?
You can request a quote for 2-Methyl-3(2-furyl)acrolein directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methyl-3(2-furyl)acrolein?
Yes, CoreyChem provides custom synthesis services for 2-Methyl-3(2-furyl)acrolein and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.