4-Amino-5-hydroxybenzene-1,2-dicarbonitrile
TL;DR: 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile (CAS 893763-28-5) is a chemical compound with molecular formula C8H5N3O and molecular weight 159.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5-hydroxybenzene-1,2-dicarbonitrile
Also Known As: 4-Amino-5-hydroxyphthalonitrile, 4-amino-5-hydroxybenzene-1,2-dicarbonitrile, 1,2-Benzenedicarbonitrile, 4-amino-5-hydroxy-, A4065/0173226
| Molecular Formula | C8H5N3O |
|---|---|
| Molecular Weight | 159.04 g/mol |
| LogP | 0.71776 |
| Topological Polar Surface Area | 93.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.04326 |
| Heavy Atoms | 12 |
| Complexity | 358.9896 |
Chemical Identifiers
| CAS Number | 893763-28-5 |
|---|---|
| SMILES | C1=C(C(=CC(=C1N)O)C#N)C#N |
Product Overview
4-Amino-5-hydroxybenzene-1,2-dicarbonitrile (CAS 893763-28-5), with molecular formula C8H5N3O and molecular weight 159.04 g/mol. IUPAC: 4-amino-5-hydroxybenzene-1,2-dicarbonitrile.
Chemical Property Profile of 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile
Property Insights of 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile
The XLogP value of 0.71776 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile. The TPSA of 93.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile. Following Lipinski's Rule of Five, 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile 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 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile?
The CAS number of 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile is 893763-28-5.
What is the molecular formula of 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile?
The molecular formula of 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile is C8H5N3O.
What is the molecular weight of 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile?
The molecular weight of 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile is 159.04 g/mol.
Where can I buy 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile?
You can request a quote for 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-5-hydroxybenzene-1,2-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.