3-Methoxy-4,5-methylenedioxycinnamaldehyde
TL;DR: 3-Methoxy-4,5-methylenedioxycinnamaldehyde (CAS 54976-67-9) is a chemical compound with molecular formula C11H10O4 and molecular weight 206.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enal
Also Known As: 3-Methoxy-4,5-methylenedioxycinnamaldehyde, 16alpha-Bromo-17beta-estradiol, 1-(3-Methoxybenzyl)-2-thiourea, (E)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enal, 3-(7-Methoxybenzo[d][1,3]dioxol-5-yl)acrylaldehyde
| Molecular Formula | C11H10O4 |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 1.636 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.0579 |
| Heavy Atoms | 15 |
| Complexity | 409.2941 |
Chemical Identifiers
| CAS Number | 54976-67-9 |
|---|---|
| SMILES | COC1=CC(=CC2=C1OCO2)/C=C/C=O |
Product Overview
3-Methoxy-4,5-methylenedioxycinnamaldehyde (CAS 54976-67-9), with molecular formula C11H10O4 and molecular weight 206.06 g/mol. IUPAC: (E)-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enal.
Chemical Property Profile of 3-Methoxy-4,5-methylenedioxycinnamaldehyde
Property Insights of 3-Methoxy-4,5-methylenedioxycinnamaldehyde
The XLogP value of 1.636 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-4,5-methylenedioxycinnamaldehyde. With a topological polar surface area (TPSA) of 44.76 Ų, 3-Methoxy-4,5-methylenedioxycinnamaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxy-4,5-methylenedioxycinnamaldehyde has 0 hydrogen bond donor(s) and 4 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 3-Methoxy-4,5-methylenedioxycinnamaldehyde?
The CAS number of 3-Methoxy-4,5-methylenedioxycinnamaldehyde is 54976-67-9.
What is the molecular formula of 3-Methoxy-4,5-methylenedioxycinnamaldehyde?
The molecular formula of 3-Methoxy-4,5-methylenedioxycinnamaldehyde is C11H10O4.
What is the molecular weight of 3-Methoxy-4,5-methylenedioxycinnamaldehyde?
The molecular weight of 3-Methoxy-4,5-methylenedioxycinnamaldehyde is 206.06 g/mol.
Where can I buy 3-Methoxy-4,5-methylenedioxycinnamaldehyde?
You can request a quote for 3-Methoxy-4,5-methylenedioxycinnamaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-4,5-methylenedioxycinnamaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-4,5-methylenedioxycinnamaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.