1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)-
TL;DR: 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)- (CAS 68400-52-2) is a chemical compound with molecular formula C13H18O2 and molecular weight 206.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-2-methyl-1-(4-propylphenyl)propan-1-one
Also Known As: 2-Hydroxy-2-methyl-4'-propylpropiophenone, 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)-, 2-hydroxy-2-methyl-1-(4-propylphenyl)propan-1-one, 1-(4'-Propylphenyl)-2-hydroxy-2-methylpropanone-1, 2-Hydroxy-2-methyl-1-(4-propylphenyl)-1-propanone
| Molecular Formula | C13H18O2 |
|---|---|
| Molecular Weight | 206.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.13068 |
| Heavy Atoms | 15 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 68400-52-2 |
|---|---|
| SMILES | CCCC1=CC=C(C=C1)C(=O)C(C)(C)O |
| InChIKey | VOGSBOVWPQXXAH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)- (CAS 68400-52-2), with molecular formula C13H18O2 and molecular weight 206.13 g/mol. IUPAC: 2-hydroxy-2-methyl-1-(4-propylphenyl)propan-1-one.
Chemical Property Profile of 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)-
Property Insights of 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)-. With a topological polar surface area (TPSA) of 37.3 Ų, 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)- has 1 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 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)-?
The CAS number of 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)- is 68400-52-2.
What is the molecular formula of 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)-?
The molecular formula of 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)- is C13H18O2.
What is the molecular weight of 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)-?
The molecular weight of 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)- is 206.13 g/mol.
Where can I buy 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)-?
You can request a quote for 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 2-hydroxy-2-methyl-1-(4-propylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.