3,4-Diaminophenol
TL;DR: 3,4-Diaminophenol (CAS 1028328-27-9) is a chemical compound with molecular formula C6H8N2O and molecular weight 124.06366 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4-diaminophenol
Also Known As: 3,4-diaminophenol, Phenol, 3,4-diamino-, 3,4-diamino-phenol, 3,4-diamino phenol, Esomeprazole Impurity 12
Technical Specifications
| Molecular Formula | C6H8N2O |
| Molecular Weight | 124.06366 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 72.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 124.06366 Da |
| Heavy Atoms | 9 |
| Complexity | 97.0 |
| SMILES | C1=CC(=C(C=C1O)N)N |
| InChIKey | OVOZYARDXPHRDL-UHFFFAOYSA-N |
Chemical Property Profile of 3,4-Diaminophenol
Property Insights of 3,4-Diaminophenol
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Diaminophenol. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Diaminophenol. Following Lipinski's Rule of Five, 3,4-Diaminophenol has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,4-Diaminophenol?
The CAS number of 3,4-Diaminophenol is 1028328-27-9.
What is the molecular formula of 3,4-Diaminophenol?
The molecular formula of 3,4-Diaminophenol is C6H8N2O.
What is the molecular weight of 3,4-Diaminophenol?
The molecular weight of 3,4-Diaminophenol is 124.06366 g/mol.
Where can I buy 3,4-Diaminophenol?
You can request a quote for 3,4-Diaminophenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4-Diaminophenol?
Yes, CoreyChem provides custom synthesis services for 3,4-Diaminophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.