3,4,4-三甲基戊-2-烯酰胺
TL;DR: 3,4,4-三甲基戊-2-烯酰胺 (CAS 860546-40-3) is a chemical compound with molecular formula C8H15NO and molecular weight 141.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,4-三甲基戊-2-烯酰胺
3,4,4-trimethylpent-2-enamide
Also Known As: 3,4,4-trimethylpent-2-enamide, (2E)-3,4,4-TRIMETHYLPENT-2-ENAMIDE
| Molecular Formula | C8H15NO |
|---|---|
| Molecular Weight | 141.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 141.11537 |
| Heavy Atoms | 10 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 860546-40-3 |
|---|---|
| SMILES | CC(=CC(=O)N)C(C)(C)C |
| InChIKey | IVZXTSKOMNRMCD-UHFFFAOYSA-N |
Product Overview
3,4,4-三甲基戊-2-烯酰胺 (CAS 860546-40-3), with molecular formula C8H15NO and molecular weight 141.12 g/mol. IUPAC: 3,4,4-trimethylpent-2-enamide.
Chemical Property Profile of 3,4,4-三甲基戊-2-烯酰胺
Property Insights of 3,4,4-三甲基戊-2-烯酰胺
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,4-三甲基戊-2-烯酰胺. With a topological polar surface area (TPSA) of 43.1 Ų, 3,4,4-三甲基戊-2-烯酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,4-三甲基戊-2-烯酰胺 has 1 hydrogen bond donor(s) and 1 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 3,4,4-三甲基戊-2-烯酰胺?
The CAS number of 3,4,4-三甲基戊-2-烯酰胺 is 860546-40-3.
What is the molecular formula of 3,4,4-三甲基戊-2-烯酰胺?
The molecular formula of 3,4,4-三甲基戊-2-烯酰胺 is C8H15NO.
What is the molecular weight of 3,4,4-三甲基戊-2-烯酰胺?
The molecular weight of 3,4,4-三甲基戊-2-烯酰胺 is 141.12 g/mol.
Where can I buy 3,4,4-三甲基戊-2-烯酰胺?
You can request a quote for 3,4,4-三甲基戊-2-烯酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,4-三甲基戊-2-烯酰胺?
Yes, KEHONG BIO provides custom synthesis services for 3,4,4-三甲基戊-2-烯酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.