Benzoic acid, 3-(benzoyloxy)-
TL;DR: Benzoic acid, 3-(benzoyloxy)- (CAS 28547-22-0) is a chemical compound with molecular formula C14H10O4 and molecular weight 242.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzoyloxybenzoic acid
Also Known As: 3-benzoyloxybenzoic Acid, Benzoic acid, 3-(benzoyloxy)-, Benzoesaeure-m-benzoat-ester, 3-(BENZOYLOXY)BENZOIC ACID, RefChem:327155
| Molecular Formula | C14H10O4 |
|---|---|
| Molecular Weight | 242.06 g/mol |
| LogP | 2.604 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.0579 |
| Heavy Atoms | 18 |
| Complexity | 575.35767 |
Chemical Identifiers
| CAS Number | 28547-22-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)O |
Product Overview
Benzoic acid, 3-(benzoyloxy)- (CAS 28547-22-0), with molecular formula C14H10O4 and molecular weight 242.06 g/mol. IUPAC: 3-benzoyloxybenzoic acid.
Chemical Property Profile of Benzoic acid, 3-(benzoyloxy)-
Property Insights of Benzoic acid, 3-(benzoyloxy)-
The XLogP value of 2.604 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 3-(benzoyloxy)-. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 3-(benzoyloxy)-. Following Lipinski's Rule of Five, Benzoic acid, 3-(benzoyloxy)- has 1 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 Benzoic acid, 3-(benzoyloxy)-?
The CAS number of Benzoic acid, 3-(benzoyloxy)- is 28547-22-0.
What is the molecular formula of Benzoic acid, 3-(benzoyloxy)-?
The molecular formula of Benzoic acid, 3-(benzoyloxy)- is C14H10O4.
What is the molecular weight of Benzoic acid, 3-(benzoyloxy)-?
The molecular weight of Benzoic acid, 3-(benzoyloxy)- is 242.06 g/mol.
Where can I buy Benzoic acid, 3-(benzoyloxy)-?
You can request a quote for Benzoic acid, 3-(benzoyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3-(benzoyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3-(benzoyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.