2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)-
TL;DR: 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)- (CAS 29605-88-7) is a chemical compound with molecular formula C9H12O2 and molecular weight 152.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-hydroxy-3-methyl-2-prop-2-enylcyclopent-2-en-1-one
Also Known As: Allethrolone, Allethrolon, Allethrolone (VAN), ()-2-cyclopenten-1-on, 2-Allyl-4-hydroxy-3-methyl-2-cyclopenten-1-one
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H12O2 |
| Molecular Weight | 152.08372 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.08372 Da |
| Heavy Atoms | 11 |
| Complexity | 226.0 |
| SMILES | CC1=C(C(=O)CC1O)CC=C |
| InChIKey | KZYVOZABVXLALY-UHFFFAOYSA-N |
Chemical Property Profile of 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)-
Property Insights of 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)-
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)-. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)-?
The CAS number of 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)- is 29605-88-7.
What is the molecular formula of 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)-?
The molecular formula of 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)- is C9H12O2.
What is the molecular weight of 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)-?
The molecular weight of 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)- is 152.08372 g/mol.
Where can I buy 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)-?
You can request a quote for 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)-?
Yes, CoreyChem provides custom synthesis services for 2-Cyclopenten-1-one, 4-hydroxy-3-methyl-2-(2-propen-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.