5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one
TL;DR: 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one (CAS 72036-53-4) is a chemical compound with molecular formula C20H20O and molecular weight 276.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-3-(4-phenylphenyl)cyclohex-2-en-1-one
Also Known As: 5,5-Dimethyl-3- cyclohex-2-enone, 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one, 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-enone, 5,5-dimethyl-3-(4-phenylphenyl)cyclohex-2-en-1-one, 5,5-Dimethyl-3-(p-phenylphenyl)-cyclohex-2-en-1-one
| Molecular Formula | C20H20O |
|---|---|
| Molecular Weight | 276.15 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 276.15143 |
| Heavy Atoms | 21 |
| Complexity | 404.0 |
Chemical Identifiers
| CAS Number | 72036-53-4 |
|---|---|
| SMILES | CC1(CC(=CC(=O)C1)C2=CC=C(C=C2)C3=CC=CC=C3)C |
| InChIKey | KZFBORHKRNSIDA-UHFFFAOYSA-N |
Product Overview
5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one (CAS 72036-53-4), with molecular formula C20H20O and molecular weight 276.15 g/mol. IUPAC: 5,5-dimethyl-3-(4-phenylphenyl)cyclohex-2-en-1-one.
Chemical Property Profile of 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one
Property Insights of 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one
The XLogP value of 4.5 indicates that 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one 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 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one?
The CAS number of 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one is 72036-53-4.
What is the molecular formula of 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one?
The molecular formula of 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one is C20H20O.
What is the molecular weight of 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one?
The molecular weight of 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one is 276.15 g/mol.
Where can I buy 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one?
You can request a quote for 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Dimethyl-3-(p-phenylphenyl)cyclohex-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.