Violaceic acid
TL;DR: Violaceic acid (CAS 81827-48-7) is a chemical compound with molecular formula C15H12O6 and molecular weight 288.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-formyl-2-hydroxyphenoxy)-3-methoxybenzoic acid
Also Known As: Violaceic acid, Violaceate, Benzoic acid, 4-(4-formyl-2-hydroxyphenoxy)-3-methoxy-, 4-(4-formyl-2-hydroxyphenoxy)-3-methoxybenzoic acid, 4-(4-ormyl-2-hydroxyphenoxy)-3-methoxybenzoic acid
| Molecular Formula | C15H12O6 |
|---|---|
| Molecular Weight | 288.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.0634 |
| Heavy Atoms | 21 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 81827-48-7 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(=O)O)OC2=C(C=C(C=C2)C=O)O |
| InChIKey | FXAPIKRPPXOWOW-UHFFFAOYSA-N |
Product Overview
Violaceic acid (CAS 81827-48-7), with molecular formula C15H12O6 and molecular weight 288.06 g/mol. IUPAC: 4-(4-formyl-2-hydroxyphenoxy)-3-methoxybenzoic acid.
Chemical Property Profile of Violaceic acid
Property Insights of Violaceic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Violaceic acid. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Violaceic acid. Following Lipinski's Rule of Five, Violaceic acid has 2 hydrogen bond donor(s) and 6 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 Violaceic acid?
The CAS number of Violaceic acid is 81827-48-7.
What is the molecular formula of Violaceic acid?
The molecular formula of Violaceic acid is C15H12O6.
What is the molecular weight of Violaceic acid?
The molecular weight of Violaceic acid is 288.06 g/mol.
Where can I buy Violaceic acid?
You can request a quote for Violaceic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Violaceic acid?
Yes, KEHONG BIO provides custom synthesis services for Violaceic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.