2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde
TL;DR: 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde (CAS 861208-24-4) is a chemical compound with molecular formula C13H14O5 and molecular weight 250.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4-trimethoxy-6-prop-2-ynoxybenzaldehyde
Also Known As: 2,3,4-trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde, 2,3,4-trimethoxy-6-prop-2-ynoxybenzaldehyde, 2,3,4-trimethoxy-6-(prop-2-yn-1-yloxy)benzaldehyde, 1Y-0929, 2,3,4-Trimethoxy-6-(2-propyn-1-yloxy)benzaldehyde
| Molecular Formula | C13H14O5 |
|---|---|
| Molecular Weight | 250.08 g/mol |
| LogP | 1.5369 |
| Topological Polar Surface Area | 53.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 250.08412 |
| Heavy Atoms | 18 |
| Complexity | 473.25043 |
Chemical Identifiers
| CAS Number | 861208-24-4 |
|---|---|
| SMILES | COC1=C(C(=C(C(=C1)OCC#C)C=O)OC)OC |
Product Overview
2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde (CAS 861208-24-4), with molecular formula C13H14O5 and molecular weight 250.08 g/mol. IUPAC: 2,3,4-trimethoxy-6-prop-2-ynoxybenzaldehyde.
Chemical Property Profile of 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde
Property Insights of 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde
The XLogP value of 1.5369 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde. With a topological polar surface area (TPSA) of 53.99 Ų, 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde has 0 hydrogen bond donor(s) and 5 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 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde?
The CAS number of 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde is 861208-24-4.
What is the molecular formula of 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde?
The molecular formula of 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde is C13H14O5.
What is the molecular weight of 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde?
The molecular weight of 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde is 250.08 g/mol.
Where can I buy 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde?
You can request a quote for 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4-Trimethoxy-6-(2-propynyloxy)benzenecarbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.