2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione
TL;DR: 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione (CAS 78426-09-2) is a chemical compound with molecular formula C16H10O4 and molecular weight 266.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,4-dihydroxyphenyl)methylidene]indene-1,3-dione
Also Known As: 2-(3,4-dihydroxybenzylidene)-1h-indene-1,3(2h)-dione, J1.029.872E, 2-(3,4-Dihydroxybenzylidene)indan-1,3-dione, 2-(3,4-Dihydroxy-benzylidene)-indan-1,3-dione, 2-[(3,4-dihydroxyphenyl)methylene]-1H-Indene-1,3(2H)-dione
| Molecular Formula | C16H10O4 |
|---|---|
| Molecular Weight | 266.06 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.05792 |
| Heavy Atoms | 20 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 78426-09-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=CC3=CC(=C(C=C3)O)O)C2=O |
| InChIKey | HNKTYJVAICSKHB-UHFFFAOYSA-N |
Product Overview
2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione (CAS 78426-09-2), with molecular formula C16H10O4 and molecular weight 266.06 g/mol. IUPAC: 2-[(3,4-dihydroxyphenyl)methylidene]indene-1,3-dione.
Chemical Property Profile of 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione
Property Insights of 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione. Following Lipinski's Rule of Five, 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione has 2 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 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione?
The CAS number of 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione is 78426-09-2.
What is the molecular formula of 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione?
The molecular formula of 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione is C16H10O4.
What is the molecular weight of 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione?
The molecular weight of 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione is 266.06 g/mol.
Where can I buy 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione?
You can request a quote for 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dihydroxybenzylidene)-1h-indene-1,3(2h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.