1-(2,5-Dimethylphenyl)propan-2-one
TL;DR: 1-(2,5-Dimethylphenyl)propan-2-one (CAS 53291-89-7) is a chemical compound with molecular formula C11H14O and molecular weight 162.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,5-dimethylphenyl)propan-2-one
Also Known As: 1-(2,5-dimethylphenyl)propan-2-one, 2-TOLOYLACETONE, (2,5-Dimethylphenyl)acetone, 2,5-DIMETHYLPHENYLACETONE, 1-(2,5-dimethylphenyl)acetone
| Molecular Formula | C11H14O |
|---|---|
| Molecular Weight | 162.10 g/mol |
| LogP | 2.43494 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.10446 |
| Heavy Atoms | 12 |
| Complexity | 299.87247 |
Chemical Identifiers
| CAS Number | 53291-89-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)CC(=O)C |
Product Overview
1-(2,5-Dimethylphenyl)propan-2-one (CAS 53291-89-7), with molecular formula C11H14O and molecular weight 162.10 g/mol. IUPAC: 1-(2,5-dimethylphenyl)propan-2-one.
Chemical Property Profile of 1-(2,5-Dimethylphenyl)propan-2-one
Property Insights of 1-(2,5-Dimethylphenyl)propan-2-one
The XLogP value of 2.43494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,5-Dimethylphenyl)propan-2-one. With a topological polar surface area (TPSA) of 17.07 Ų, 1-(2,5-Dimethylphenyl)propan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,5-Dimethylphenyl)propan-2-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 1-(2,5-Dimethylphenyl)propan-2-one?
The CAS number of 1-(2,5-Dimethylphenyl)propan-2-one is 53291-89-7.
What is the molecular formula of 1-(2,5-Dimethylphenyl)propan-2-one?
The molecular formula of 1-(2,5-Dimethylphenyl)propan-2-one is C11H14O.
What is the molecular weight of 1-(2,5-Dimethylphenyl)propan-2-one?
The molecular weight of 1-(2,5-Dimethylphenyl)propan-2-one is 162.10 g/mol.
Where can I buy 1-(2,5-Dimethylphenyl)propan-2-one?
You can request a quote for 1-(2,5-Dimethylphenyl)propan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,5-Dimethylphenyl)propan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,5-Dimethylphenyl)propan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.