2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal
TL;DR: 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal (CAS 65114-01-4) is a chemical compound with molecular formula C13H20O and molecular weight 192.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal
Also Known As: 2-methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal, 2-methyl-4-(2,2,3-trimethylcyclopent-3-enyl)but-2-enal, 2-Butenal, 2-methyl-4-(2,2,3-trimethyl-3-cyclopenten-1-yl)-, (2E)-, 2-Butenal,2-methyl-4-(2,2,3-trimethyl-3-cyclopenten-1-yl)-, 2-Methyl-4-(2,2,3-trimethyl-3-cyclopenten-1-yl)-2-butenal
| Molecular Formula | C13H20O |
|---|---|
| Molecular Weight | 192.15 g/mol |
| LogP | 3.5141 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.15141 |
| Heavy Atoms | 14 |
| Complexity | 281.6107 |
Chemical Identifiers
| CAS Number | 65114-01-4 |
|---|---|
| SMILES | CC1=CCC(C1(C)C)CC=C(C)C=O |
Product Overview
2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal (CAS 65114-01-4), with molecular formula C13H20O and molecular weight 192.15 g/mol. IUPAC: 2-methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal.
Chemical Property Profile of 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal
Property Insights of 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal
The XLogP value of 3.5141 indicates that 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal has 0 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 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal?
The CAS number of 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal is 65114-01-4.
What is the molecular formula of 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal?
The molecular formula of 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal is C13H20O.
What is the molecular weight of 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal?
The molecular weight of 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal is 192.15 g/mol.
Where can I buy 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal?
You can request a quote for 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-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-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-4-(2,2,3-trimethylcyclopent-3-en-1-yl)but-2-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.