3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde
TL;DR: 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde (CAS 552311-69-0) is a chemical compound with molecular formula C12H12O4 and molecular weight 220.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-dimethoxy-4-prop-2-ynoxybenzaldehyde
Also Known As: 3,5-dimethoxy-4-(propargyloxy)benzaldehyde, 3,5-dimethoxy-4-prop-2-ynoxybenzaldehyde, 3,5-dimethoxy-4-prop-2-ynoxy-benzaldehyde, 3,5-dimethoxy-4-prop-2-ynyloxybenzaldehyde, 3,5-Dimethoxy-4-(2-propynyloxy)benzaldehyde
| Molecular Formula | C12H12O4 |
|---|---|
| Molecular Weight | 220.07 g/mol |
| LogP | 1.5283 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 220.07356 |
| Heavy Atoms | 16 |
| Complexity | 392.51233 |
Chemical Identifiers
| CAS Number | 552311-69-0 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OCC#C)OC)C=O |
Product Overview
3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde (CAS 552311-69-0), with molecular formula C12H12O4 and molecular weight 220.07 g/mol. IUPAC: 3,5-dimethoxy-4-prop-2-ynoxybenzaldehyde.
Chemical Property Profile of 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde
Property Insights of 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde
The XLogP value of 1.5283 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde. With a topological polar surface area (TPSA) of 44.76 Ų, 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde 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 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde?
The CAS number of 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde is 552311-69-0.
What is the molecular formula of 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde?
The molecular formula of 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde is C12H12O4.
What is the molecular weight of 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde?
The molecular weight of 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde is 220.07 g/mol.
Where can I buy 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde?
You can request a quote for 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethoxy-4-prop-2-ynyloxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.