methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate
TL;DR: methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate (CAS 5214-97-1) is a chemical compound with molecular formula C10H15NO3 and molecular weight 197.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate
Also Known As: methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate, methyl 2-acetyl-5-(dimethylamino)-2,4-pentadienoate, Methyl 2-acetyl-5-dimethylamino-penta-2,4-dienoate
| Molecular Formula | C10H15NO3 |
|---|---|
| Molecular Weight | 197.11 g/mol |
| LogP | 0.7501 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 197.1052 |
| Heavy Atoms | 14 |
| Complexity | 277.0917 |
Chemical Identifiers
| CAS Number | 5214-97-1 |
|---|---|
| SMILES | CC(=O)/C(=C\C=C\N(C)C)/C(=O)OC |
Product Overview
methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate (CAS 5214-97-1), with molecular formula C10H15NO3 and molecular weight 197.11 g/mol. IUPAC: methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate.
Chemical Property Profile of methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate
Property Insights of methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate
The XLogP value of 0.7501 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate. With a topological polar surface area (TPSA) of 46.61 Ų, methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate 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 methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate?
The CAS number of methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate is 5214-97-1.
What is the molecular formula of methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate?
The molecular formula of methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate is C10H15NO3.
What is the molecular weight of methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate?
The molecular weight of methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate is 197.11 g/mol.
Where can I buy methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate?
You can request a quote for methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate?
Yes, KEHONG BIO provides custom synthesis services for methyl (2E,4E)-2-acetyl-5-(dimethylamino)penta-2,4-dienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.