(E)-3,4-Methylenedioxycinnamaldehyde
TL;DR: (E)-3,4-Methylenedioxycinnamaldehyde (CAS 149970-44-5) is a chemical compound with molecular formula C10H8O3 and molecular weight 176.04735 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(1,3-benzodioxol-5-yl)prop-2-enal
Also Known As: 3,4-Methylenedioxycinnamaldehyde, (2E)-3-(1,3-dioxaindan-5-yl)prop-2-enal, (E)-3,4-Methylenedioxycinnamaldehyde, 1,3-Benzodioxole-5-acrolein, 3,4-Methylendioxy-zimtaldehyd
Technical Specifications
| Molecular Formula | C10H8O3 |
| Molecular Weight | 176.04735 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.04735 Da |
| Heavy Atoms | 13 |
| Complexity | 212.0 |
| SMILES | C1OC2=C(O1)C=C(C=C2)/C=C/C=O |
| InChIKey | HZUFMSJUNLSDSZ-OWOJBTEDSA-N |
Chemical Property Profile of (E)-3,4-Methylenedioxycinnamaldehyde
Property Insights of (E)-3,4-Methylenedioxycinnamaldehyde
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3,4-Methylenedioxycinnamaldehyde. With a topological polar surface area (TPSA) of 35.5 Ų, (E)-3,4-Methylenedioxycinnamaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3,4-Methylenedioxycinnamaldehyde has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (E)-3,4-Methylenedioxycinnamaldehyde?
The CAS number of (E)-3,4-Methylenedioxycinnamaldehyde is 149970-44-5.
What is the molecular formula of (E)-3,4-Methylenedioxycinnamaldehyde?
The molecular formula of (E)-3,4-Methylenedioxycinnamaldehyde is C10H8O3.
What is the molecular weight of (E)-3,4-Methylenedioxycinnamaldehyde?
The molecular weight of (E)-3,4-Methylenedioxycinnamaldehyde is 176.04735 g/mol.
Where can I buy (E)-3,4-Methylenedioxycinnamaldehyde?
You can request a quote for (E)-3,4-Methylenedioxycinnamaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-3,4-Methylenedioxycinnamaldehyde?
Yes, CoreyChem provides custom synthesis services for (E)-3,4-Methylenedioxycinnamaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.