![2-Butanone, 4-[4-(1-methylethyl)phenyl]- structure](/static/products/1052/10528-64-0.webp)
2-Butanone, 4-[4-(1-methylethyl)phenyl]-
TL;DR: 2-Butanone, 4-[4-(1-methylethyl)phenyl]- (CAS 10528-64-0) is a chemical compound with molecular formula C13H18O and molecular weight 190.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-propan-2-ylphenyl)butan-2-one
Also Known As: 4-(4-Isopropylphenyl)butan-2-one, 4-(4-propan-2-ylphenyl)butan-2-one, 2-Butanone, 4-[4-(1-methylethyl)phenyl]-, 4-[4-(propan-2-yl)phenyl]butan-2-one, AI3-21273
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H18O |
| Molecular Weight | 190.13577 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 190.13577 Da |
| Heavy Atoms | 14 |
| Complexity | 176.0 |
| SMILES | CC(C)C1=CC=C(C=C1)CCC(=O)C |
| InChIKey | URPGTYOPLRABIL-UHFFFAOYSA-N |
Chemical Property Profile of 2-Butanone, 4-[4-(1-methylethyl)phenyl]-
Property Insights of 2-Butanone, 4-[4-(1-methylethyl)phenyl]-
The XLogP value of 3.0 indicates that 2-Butanone, 4-[4-(1-methylethyl)phenyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Butanone, 4-[4-(1-methylethyl)phenyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butanone, 4-[4-(1-methylethyl)phenyl]- 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
What is the CAS number of 2-Butanone, 4-[4-(1-methylethyl)phenyl]-?
The CAS number of 2-Butanone, 4-[4-(1-methylethyl)phenyl]- is 10528-64-0.
What is the molecular formula of 2-Butanone, 4-[4-(1-methylethyl)phenyl]-?
The molecular formula of 2-Butanone, 4-[4-(1-methylethyl)phenyl]- is C13H18O.
What is the molecular weight of 2-Butanone, 4-[4-(1-methylethyl)phenyl]-?
The molecular weight of 2-Butanone, 4-[4-(1-methylethyl)phenyl]- is 190.13577 g/mol.
Where can I buy 2-Butanone, 4-[4-(1-methylethyl)phenyl]-?
You can request a quote for 2-Butanone, 4-[4-(1-methylethyl)phenyl]- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Butanone, 4-[4-(1-methylethyl)phenyl]-?
Yes, CoreyChem provides custom synthesis services for 2-Butanone, 4-[4-(1-methylethyl)phenyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.