(2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal
TL;DR: (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal (CAS 104226-69-9) is a chemical compound with molecular formula C9H14O3 and molecular weight 170.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-(oxan-2-yloxy)but-2-enal
Also Known As: TGPOB, 4-Tetrahydropyranyloxy-2-butenal, (E)-4-(oxan-2-yloxy)but-2-enal, methyl 4,9-dioxonona-5,7-dienoate, 4-(OXAN-2-YLOXY)BUT-2-ENAL
| Molecular Formula | C9H14O3 |
|---|---|
| Molecular Weight | 170.09 g/mol |
| LogP | 1.2847 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.0943 |
| Heavy Atoms | 12 |
| Complexity | 147.85263 |
Chemical Identifiers
| CAS Number | 104226-69-9 |
|---|---|
| SMILES | C1CCOC(C1)OC/C=C/C=O |
Product Overview
(2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal (CAS 104226-69-9), with molecular formula C9H14O3 and molecular weight 170.09 g/mol. IUPAC: (E)-4-(oxan-2-yloxy)but-2-enal.
Chemical Property Profile of (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal
Property Insights of (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal
The XLogP value of 1.2847 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal. With a topological polar surface area (TPSA) of 35.53 Ų, (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal 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
Frequently Asked Questions
What is the CAS number of (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal?
The CAS number of (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal is 104226-69-9.
What is the molecular formula of (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal?
The molecular formula of (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal is C9H14O3.
What is the molecular weight of (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal?
The molecular weight of (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal is 170.09 g/mol.
Where can I buy (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal?
You can request a quote for (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal?
Yes, KEHONG BIO provides custom synthesis services for (2E)-4-((Tetrahydro-2H-pyran-2-yl)oxy)-2-butenal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.