Phenyl 3-propanoylbenzoate
TL;DR: Phenyl 3-propanoylbenzoate (CAS 354785-99-2) is a chemical compound with molecular formula C16H14O3 and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 3-propanoylbenzoate
Also Known As: phenyl 3-propanoylbenzoate, phenyl 3-propionylbenzoate, Phenyl 3-(1-oxopropyl)benzoate, AN-907/14236043
| Molecular Formula | C16H14O3 |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | 3.4985 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.0943 |
| Heavy Atoms | 19 |
| Complexity | 587.9529 |
Chemical Identifiers
| CAS Number | 354785-99-2 |
|---|---|
| SMILES | CCC(=O)C1=CC(=CC=C1)C(=O)OC2=CC=CC=C2 |
Product Overview
Phenyl 3-propanoylbenzoate (CAS 354785-99-2), with molecular formula C16H14O3 and molecular weight 254.09 g/mol. IUPAC: phenyl 3-propanoylbenzoate.
Chemical Property Profile of Phenyl 3-propanoylbenzoate
Property Insights of Phenyl 3-propanoylbenzoate
The XLogP value of 3.4985 indicates that Phenyl 3-propanoylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, Phenyl 3-propanoylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl 3-propanoylbenzoate 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 Phenyl 3-propanoylbenzoate?
The CAS number of Phenyl 3-propanoylbenzoate is 354785-99-2.
What is the molecular formula of Phenyl 3-propanoylbenzoate?
The molecular formula of Phenyl 3-propanoylbenzoate is C16H14O3.
What is the molecular weight of Phenyl 3-propanoylbenzoate?
The molecular weight of Phenyl 3-propanoylbenzoate is 254.09 g/mol.
Where can I buy Phenyl 3-propanoylbenzoate?
You can request a quote for Phenyl 3-propanoylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl 3-propanoylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl 3-propanoylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.