2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal
TL;DR: 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal (CAS 38971-86-7) is a chemical compound with molecular formula C14H12O4 and molecular weight 244.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4-(2-oxochromen-7-yl)oxybut-2-enal
Also Known As: 2-methyl-4-[oxy]-2-butenal
| Molecular Formula | C14H12O4 |
|---|---|
| Molecular Weight | 244.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.07356 |
| Heavy Atoms | 18 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 38971-86-7 |
|---|---|
| SMILES | CC(=CCOC1=CC2=C(C=C1)C=CC(=O)O2)C=O |
| InChIKey | BOEYBMJEVSXRSZ-UHFFFAOYSA-N |
Product Overview
2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal (CAS 38971-86-7), with molecular formula C14H12O4 and molecular weight 244.07 g/mol. IUPAC: 2-methyl-4-(2-oxochromen-7-yl)oxybut-2-enal.
Chemical Property Profile of 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal
Property Insights of 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal 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 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal?
The CAS number of 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal is 38971-86-7.
What is the molecular formula of 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal?
The molecular formula of 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal is C14H12O4.
What is the molecular weight of 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal?
The molecular weight of 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal is 244.07 g/mol.
Where can I buy 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal?
You can request a quote for 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-4-(2-oxochromen-7-yl)oxybut-2-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.