Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester
TL;DR: Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester (CAS 264145-76-8) is a chemical compound with molecular formula C9H14O2 and molecular weight 154.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylbut-2-enyl cyclopropanecarboxylate
Also Known As: Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester, 3-methylbut-2-enyl cyclopropanecarboxylate, 3-METHYLBUT-2-EN-1-YL CYCLOPROPANECARBOXYLATE, J1.306.076B, cyclopropanecarboxylic acid, 3-methyl-2-butenyl ester
| Molecular Formula | C9H14O2 |
|---|---|
| Molecular Weight | 154.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 154.09938 |
| Heavy Atoms | 11 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 264145-76-8 |
|---|---|
| SMILES | CC(=CCOC(=O)C1CC1)C |
| InChIKey | QKSQPNPCCOABAK-UHFFFAOYSA-N |
Product Overview
Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester (CAS 264145-76-8), with molecular formula C9H14O2 and molecular weight 154.10 g/mol. IUPAC: 3-methylbut-2-enyl cyclopropanecarboxylate.
Chemical Property Profile of Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester
Property Insights of Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester 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 Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester?
The CAS number of Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester is 264145-76-8.
What is the molecular formula of Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester?
The molecular formula of Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester is C9H14O2.
What is the molecular weight of Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester?
The molecular weight of Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester is 154.10 g/mol.
Where can I buy Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester?
You can request a quote for Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cyclopropanecarboxylic acid, 3-methylbut-2-enyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.