Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)-
TL;DR: Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)- (CAS 25090-79-3) is a chemical compound with molecular formula C15H20O and molecular weight 216.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,4-trimethyl-4-(4-methylphenyl)cyclopentan-1-one
Also Known As: beta-Cuparenone, Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)-, 3,3,4-trimethyl-4-(4-methylphenyl)cyclopentan-1-one, 3,3,4-Trimethyl-4-(4-methylphenyl)cyclopentanone, J2.303.007A
| Molecular Formula | C15H20O |
|---|---|
| Molecular Weight | 216.15 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.15141 |
| Heavy Atoms | 16 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 25090-79-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2(CC(=O)CC2(C)C)C |
| InChIKey | MTWLTRIBMFLOIL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)- (CAS 25090-79-3), with molecular formula C15H20O and molecular weight 216.15 g/mol. IUPAC: 3,3,4-trimethyl-4-(4-methylphenyl)cyclopentan-1-one.
Chemical Property Profile of Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)-
Property Insights of Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)-
The XLogP value of 3.5 indicates that Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)- 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 Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)-?
The CAS number of Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)- is 25090-79-3.
What is the molecular formula of Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)-?
The molecular formula of Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)- is C15H20O.
What is the molecular weight of Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)-?
The molecular weight of Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)- is 216.15 g/mol.
Where can I buy Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)-?
You can request a quote for Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.