(Z)-2-methyl-4-oxopent-2-enal
TL;DR: (Z)-2-methyl-4-oxopent-2-enal (CAS 104613-83-4) is a chemical compound with molecular formula C6H8O2 and molecular weight 112.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-2-methyl-4-oxopent-2-enal
Also Known As: (Z)-2-methyl-4-oxopent-2-enal, 2-Pyridinamine,monoacetate, 2-Pentenal, 2-methyl-4-oxo-, (Z)-, (Z)-2-Methyl-4-oxo-2-pentenal, (E)-2-methyl-4-oxo-pent-2-enal
| Molecular Formula | C6H8O2 |
|---|---|
| Molecular Weight | 112.05 g/mol |
| LogP | 0.7206 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 112.05243 |
| Heavy Atoms | 8 |
| Complexity | 133.46396 |
Chemical Identifiers
| CAS Number | 104613-83-4 |
|---|---|
| SMILES | C/C(=C/C(=O)C)/C=O |
Product Overview
(Z)-2-methyl-4-oxopent-2-enal (CAS 104613-83-4), with molecular formula C6H8O2 and molecular weight 112.05 g/mol. IUPAC: (Z)-2-methyl-4-oxopent-2-enal.
Chemical Property Profile of (Z)-2-methyl-4-oxopent-2-enal
Property Insights of (Z)-2-methyl-4-oxopent-2-enal
The XLogP value of 0.7206 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-2-methyl-4-oxopent-2-enal. With a topological polar surface area (TPSA) of 34.14 Ų, (Z)-2-methyl-4-oxopent-2-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-2-methyl-4-oxopent-2-enal has 0 hydrogen bond donor(s) and 2 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 (Z)-2-methyl-4-oxopent-2-enal?
The CAS number of (Z)-2-methyl-4-oxopent-2-enal is 104613-83-4.
What is the molecular formula of (Z)-2-methyl-4-oxopent-2-enal?
The molecular formula of (Z)-2-methyl-4-oxopent-2-enal is C6H8O2.
What is the molecular weight of (Z)-2-methyl-4-oxopent-2-enal?
The molecular weight of (Z)-2-methyl-4-oxopent-2-enal is 112.05 g/mol.
Where can I buy (Z)-2-methyl-4-oxopent-2-enal?
You can request a quote for (Z)-2-methyl-4-oxopent-2-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-methyl-4-oxopent-2-enal?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-methyl-4-oxopent-2-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.