4-Methyl-4-phenyl-2,5-cyclohexadien-1-one
TL;DR: 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one (CAS 28937-18-0) is a chemical compound with molecular formula C13H12O and molecular weight 184.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-4-phenylcyclohexa-2,5-dien-1-one
Also Known As: 4-Methyl-4-phenylcyclohexadienone, 4-METHYL-4-PHENYL-CYCLOHEXA-2,5-DIENONE, 1-Methyl[1,1'-biphenyl]-4(1H)-one, 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one, 4-methyl-4-phenylcyclohexa-2,5-dien-1-one
| Molecular Formula | C13H12O |
|---|---|
| Molecular Weight | 184.09 g/mol |
| LogP | 2.6394 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 184.08882 |
| Heavy Atoms | 14 |
| Complexity | 382.50357 |
Chemical Identifiers
| CAS Number | 28937-18-0 |
|---|---|
| SMILES | CC1(C=CC(=O)C=C1)C2=CC=CC=C2 |
Product Overview
4-Methyl-4-phenyl-2,5-cyclohexadien-1-one (CAS 28937-18-0), with molecular formula C13H12O and molecular weight 184.09 g/mol. IUPAC: 4-methyl-4-phenylcyclohexa-2,5-dien-1-one.
Chemical Property Profile of 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one
Property Insights of 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one
The XLogP value of 2.6394 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one. With a topological polar surface area (TPSA) of 17.07 Ų, 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-4-phenyl-2,5-cyclohexadien-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 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one?
The CAS number of 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one is 28937-18-0.
What is the molecular formula of 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one?
The molecular formula of 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one is C13H12O.
What is the molecular weight of 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one?
The molecular weight of 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one is 184.09 g/mol.
Where can I buy 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one?
You can request a quote for 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-4-phenyl-2,5-cyclohexadien-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.