Pyrogallin
TL;DR: Pyrogallin (CAS 947-60-4) is a chemical compound with molecular formula C11H8O4 and molecular weight 204.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-trihydroxybenzo[7]annulen-6-one
Also Known As: Spectrum2_000553, Spectrum3_000250, Spectrum4_001548, Spectrum5_000116, DivK1c_006409
| Molecular Formula | C11H8O4 |
|---|---|
| Molecular Weight | 204.04 g/mol |
| LogP | 1.3168 |
| Topological Polar Surface Area | 77.76 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.04225 |
| Heavy Atoms | 15 |
| Complexity | 589.7862 |
Chemical Identifiers
| CAS Number | 947-60-4 |
|---|---|
| SMILES | C1=CC(=O)C(=C2C(=C1)C=CC(=C2O)O)O |
Product Overview
Pyrogallin (CAS 947-60-4), with molecular formula C11H8O4 and molecular weight 204.04 g/mol. IUPAC: 3,4,5-trihydroxybenzo[7]annulen-6-one.
Chemical Property Profile of Pyrogallin
Property Insights of Pyrogallin
The XLogP value of 1.3168 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrogallin. The TPSA of 77.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrogallin. Following Lipinski's Rule of Five, Pyrogallin has 3 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 Pyrogallin?
The CAS number of Pyrogallin is 947-60-4.
What is the molecular formula of Pyrogallin?
The molecular formula of Pyrogallin is C11H8O4.
What is the molecular weight of Pyrogallin?
The molecular weight of Pyrogallin is 204.04 g/mol.
Where can I buy Pyrogallin?
You can request a quote for Pyrogallin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrogallin?
Yes, KEHONG BIO provides custom synthesis services for Pyrogallin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.