4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-
TL;DR: 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)- (CAS 55730-89-7) 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.
5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-2-one
Also Known As: 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-, 5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-2-one, 5-(2,2,3-Trimethyl-3-cyclopenten-1-yl)pent-4-en-2-one, EINECS 259-781-3, RefChem:526238
| Molecular Formula | C13H20O |
|---|---|
| Molecular Weight | 192.15 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.15141 |
| Heavy Atoms | 14 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 55730-89-7 |
|---|---|
| SMILES | CC1=CCC(C1(C)C)C=CCC(=O)C |
| InChIKey | BLZZNBSCWYINFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)- (CAS 55730-89-7), with molecular formula C13H20O and molecular weight 192.15 g/mol. IUPAC: 5-(2,2,3-trimethylcyclopent-3-en-1-yl)pent-4-en-2-one.
Chemical Property Profile of 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-
Property Insights of 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-. With a topological polar surface area (TPSA) of 17.1 Ų, 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)- 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 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-?
The CAS number of 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)- is 55730-89-7.
What is the molecular formula of 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-?
The molecular formula of 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)- is C13H20O.
What is the molecular weight of 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-?
The molecular weight of 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)- is 192.15 g/mol.
Where can I buy 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-?
You can request a quote for 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 4-Penten-2-one, 5-(2,2,3-trimethyl-3-cyclopenten-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.