1-Propanone, 1-(2-hydroxy-5-methylphenyl)-
TL;DR: 1-Propanone, 1-(2-hydroxy-5-methylphenyl)- (CAS 938-45-4) is a chemical compound with molecular formula C10H12O2 and molecular weight 164.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-hydroxy-5-methylphenyl)propan-1-one
Also Known As: 2'-Hydroxy-5'-methylpropiophenone, 1-(2-hydroxy-5-methylphenyl)propan-1-one, 6-Hydroxyindole, 2-Propionyl-p-cresol, 2-Propionyl-p-kresol
| Molecular Formula | C10H12O2 |
|---|---|
| Molecular Weight | 164.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 164.08372 |
| Heavy Atoms | 12 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 938-45-4 |
|---|---|
| SMILES | CCC(=O)C1=C(C=CC(=C1)C)O |
| InChIKey | CXZJBPYDVCLMFX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propanone, 1-(2-hydroxy-5-methylphenyl)- (CAS 938-45-4), with molecular formula C10H12O2 and molecular weight 164.08 g/mol. IUPAC: 1-(2-hydroxy-5-methylphenyl)propan-1-one.
Chemical Property Profile of 1-Propanone, 1-(2-hydroxy-5-methylphenyl)-
Property Insights of 1-Propanone, 1-(2-hydroxy-5-methylphenyl)-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanone, 1-(2-hydroxy-5-methylphenyl)-. With a topological polar surface area (TPSA) of 37.3 Ų, 1-Propanone, 1-(2-hydroxy-5-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanone, 1-(2-hydroxy-5-methylphenyl)- 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, 1-(2-hydroxy-5-methylphenyl)-?
The CAS number of 1-Propanone, 1-(2-hydroxy-5-methylphenyl)- is 938-45-4.
What is the molecular formula of 1-Propanone, 1-(2-hydroxy-5-methylphenyl)-?
The molecular formula of 1-Propanone, 1-(2-hydroxy-5-methylphenyl)- is C10H12O2.
What is the molecular weight of 1-Propanone, 1-(2-hydroxy-5-methylphenyl)-?
The molecular weight of 1-Propanone, 1-(2-hydroxy-5-methylphenyl)- is 164.08 g/mol.
Where can I buy 1-Propanone, 1-(2-hydroxy-5-methylphenyl)-?
You can request a quote for 1-Propanone, 1-(2-hydroxy-5-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanone, 1-(2-hydroxy-5-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 1-(2-hydroxy-5-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.