1-(4-Benzylphenyl)-1-butanone
TL;DR: 1-(4-Benzylphenyl)-1-butanone (CAS 17302-69-1) is a chemical compound with molecular formula C17H18O and molecular weight 238.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-benzylphenyl)butan-1-one
Also Known As: 1-(4-Benzylphenyl)-1-butanone, 1-(4-benzylphenyl)butan-1-one, Butyrophenone, 4'-benzyl-, methanethiol,deprotonated form, 1-Butanone,1-[4-(phenylmethyl)phenyl]-
| Molecular Formula | C17H18O |
|---|---|
| Molecular Weight | 238.14 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 238.13577 |
| Heavy Atoms | 18 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 17302-69-1 |
|---|---|
| SMILES | CCCC(=O)C1=CC=C(C=C1)CC2=CC=CC=C2 |
| InChIKey | CQGHAVUWNSCNMH-UHFFFAOYSA-N |
Product Overview
1-(4-Benzylphenyl)-1-butanone (CAS 17302-69-1), with molecular formula C17H18O and molecular weight 238.14 g/mol. IUPAC: 1-(4-benzylphenyl)butan-1-one.
Chemical Property Profile of 1-(4-Benzylphenyl)-1-butanone
Property Insights of 1-(4-Benzylphenyl)-1-butanone
The XLogP value of 4.7 indicates that 1-(4-Benzylphenyl)-1-butanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1-(4-Benzylphenyl)-1-butanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Benzylphenyl)-1-butanone 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 1-(4-Benzylphenyl)-1-butanone?
The CAS number of 1-(4-Benzylphenyl)-1-butanone is 17302-69-1.
What is the molecular formula of 1-(4-Benzylphenyl)-1-butanone?
The molecular formula of 1-(4-Benzylphenyl)-1-butanone is C17H18O.
What is the molecular weight of 1-(4-Benzylphenyl)-1-butanone?
The molecular weight of 1-(4-Benzylphenyl)-1-butanone is 238.14 g/mol.
Where can I buy 1-(4-Benzylphenyl)-1-butanone?
You can request a quote for 1-(4-Benzylphenyl)-1-butanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Benzylphenyl)-1-butanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Benzylphenyl)-1-butanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.