![3-[4-(4-Methylphenyl)phenoxy]butan-2-one structure](/static/products/4497/449737-08-0.webp)
3-[4-(4-Methylphenyl)phenoxy]butan-2-one
TL;DR: 3-[4-(4-Methylphenyl)phenoxy]butan-2-one (CAS 449737-08-0) is a chemical compound with molecular formula C17H18O2 and molecular weight 254.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-methylphenyl)phenoxy]butan-2-one
Also Known As: 3-[4-(4-methylphenyl)phenoxy]butan-2-one, 3-[(4'-METHYLBIPHENYL-4-YL)OXY]BUTAN-2-ONE, 3-((4'-Methyl-[1,1'-biphenyl]-4-yl)oxy)butan-2-one, AURORA 17224, 3-[4-(p-tolyl)phenoxy]butan-2-one
| Molecular Formula | C17H18O2 |
|---|---|
| Molecular Weight | 254.13 g/mol |
| LogP | 4.01832 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.13068 |
| Heavy Atoms | 19 |
| Complexity | 552.82086 |
Chemical Identifiers
| CAS Number | 449737-08-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC=C(C=C2)OC(C)C(=O)C |
Product Overview
3-[4-(4-Methylphenyl)phenoxy]butan-2-one (CAS 449737-08-0), with molecular formula C17H18O2 and molecular weight 254.13 g/mol. IUPAC: 3-[4-(4-methylphenyl)phenoxy]butan-2-one.
Chemical Property Profile of 3-[4-(4-Methylphenyl)phenoxy]butan-2-one
Property Insights of 3-[4-(4-Methylphenyl)phenoxy]butan-2-one
The XLogP value of 4.01832 indicates that 3-[4-(4-Methylphenyl)phenoxy]butan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-[4-(4-Methylphenyl)phenoxy]butan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(4-Methylphenyl)phenoxy]butan-2-one has 0 hydrogen bond donor(s) and 2 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 3-[4-(4-Methylphenyl)phenoxy]butan-2-one?
The CAS number of 3-[4-(4-Methylphenyl)phenoxy]butan-2-one is 449737-08-0.
What is the molecular formula of 3-[4-(4-Methylphenyl)phenoxy]butan-2-one?
The molecular formula of 3-[4-(4-Methylphenyl)phenoxy]butan-2-one is C17H18O2.
What is the molecular weight of 3-[4-(4-Methylphenyl)phenoxy]butan-2-one?
The molecular weight of 3-[4-(4-Methylphenyl)phenoxy]butan-2-one is 254.13 g/mol.
Where can I buy 3-[4-(4-Methylphenyl)phenoxy]butan-2-one?
You can request a quote for 3-[4-(4-Methylphenyl)phenoxy]butan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(4-Methylphenyl)phenoxy]butan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(4-Methylphenyl)phenoxy]butan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.