Benzoic acid, 2-(oxophenylacetyl)-
TL;DR: Benzoic acid, 2-(oxophenylacetyl)- (CAS 3839-29-0) is a chemical compound with molecular formula C15H10O4 and molecular weight 254.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-oxo-2-phenylacetyl)benzoic acid
Also Known As: Benzoic acid, 2-(oxophenylacetyl)-, 2-(Oxophenylacetyl)benzoic acid, 2-[oxo(phenyl)acetyl]benzoic acid, O-(Phenylglyoxyloyl)benzoic acid, 2-(2-oxo-2-phenylacetyl)benzoic acid
| Molecular Formula | C15H10O4 |
|---|---|
| Molecular Weight | 254.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.0579 |
| Heavy Atoms | 19 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 3839-29-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C(=O)C2=CC=CC=C2C(=O)O |
| InChIKey | PCWNTFTUQFVICL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, 2-(oxophenylacetyl)- (CAS 3839-29-0), with molecular formula C15H10O4 and molecular weight 254.06 g/mol. IUPAC: 2-(2-oxo-2-phenylacetyl)benzoic acid.
Chemical Property Profile of Benzoic acid, 2-(oxophenylacetyl)-
Property Insights of Benzoic acid, 2-(oxophenylacetyl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-(oxophenylacetyl)-. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-(oxophenylacetyl)-. Following Lipinski's Rule of Five, Benzoic acid, 2-(oxophenylacetyl)- has 1 hydrogen bond donor(s) and 4 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 Benzoic acid, 2-(oxophenylacetyl)-?
The CAS number of Benzoic acid, 2-(oxophenylacetyl)- is 3839-29-0.
What is the molecular formula of Benzoic acid, 2-(oxophenylacetyl)-?
The molecular formula of Benzoic acid, 2-(oxophenylacetyl)- is C15H10O4.
What is the molecular weight of Benzoic acid, 2-(oxophenylacetyl)-?
The molecular weight of Benzoic acid, 2-(oxophenylacetyl)- is 254.06 g/mol.
Where can I buy Benzoic acid, 2-(oxophenylacetyl)-?
You can request a quote for Benzoic acid, 2-(oxophenylacetyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-(oxophenylacetyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-(oxophenylacetyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.