Methyl 2-propionylbenzoate
TL;DR: Methyl 2-propionylbenzoate (CAS 32025-37-9) is a chemical compound with molecular formula C11H12O3 and molecular weight 192.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-propanoylbenzoate
Also Known As: Methyl 2-propionylbenzoate, methyl 2-propanoylbenzoate, Methyl2-propionylbenzoate, Methyl 2-propionylbenzoate #, 2-(1-Oxopropyl)benzoic acid methyl ester
| Molecular Formula | C11H12O3 |
|---|---|
| Molecular Weight | 192.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.07864 |
| Heavy Atoms | 14 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 32025-37-9 |
|---|---|
| SMILES | CCC(=O)C1=CC=CC=C1C(=O)OC |
| InChIKey | PJVVSYKDAYJZCV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-propionylbenzoate (CAS 32025-37-9), with molecular formula C11H12O3 and molecular weight 192.08 g/mol. IUPAC: methyl 2-propanoylbenzoate.
Chemical Property Profile of Methyl 2-propionylbenzoate
Property Insights of Methyl 2-propionylbenzoate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-propionylbenzoate. With a topological polar surface area (TPSA) of 43.4 Ų, Methyl 2-propionylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-propionylbenzoate has 0 hydrogen bond donor(s) and 3 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 Methyl 2-propionylbenzoate?
The CAS number of Methyl 2-propionylbenzoate is 32025-37-9.
What is the molecular formula of Methyl 2-propionylbenzoate?
The molecular formula of Methyl 2-propionylbenzoate is C11H12O3.
What is the molecular weight of Methyl 2-propionylbenzoate?
The molecular weight of Methyl 2-propionylbenzoate is 192.08 g/mol.
Where can I buy Methyl 2-propionylbenzoate?
You can request a quote for Methyl 2-propionylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-propionylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-propionylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.