![2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile structure](/static/products/3693/36938-00-8.webp)
2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile
TL;DR: 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile (CAS 36938-00-8) is a chemical compound with molecular formula C10H5N3O3 and molecular weight 215.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-hydroxy-2-nitrophenyl)methylidene]propanedinitrile
Also Known As: benzylidenemalononitrile (BMN) deriv. 20, 2-[(5-hydroxy-2-nitrophenyl)methylidene]propanedinitrile, Propanedinitrile, 2-[(5-hydroxy-2-nitrophenyl)methylene]-
| Molecular Formula | C10H5N3O3 |
|---|---|
| Molecular Weight | 215.03 g/mol |
| LogP | 1.73096 |
| Topological Polar Surface Area | 110.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.0331 |
| Heavy Atoms | 16 |
| Complexity | 533.4082 |
Chemical Identifiers
| CAS Number | 36938-00-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1O)C=C(C#N)C#N)[N+](=O)[O-] |
Product Overview
2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile (CAS 36938-00-8), with molecular formula C10H5N3O3 and molecular weight 215.03 g/mol. IUPAC: 2-[(5-hydroxy-2-nitrophenyl)methylidene]propanedinitrile.
Chemical Property Profile of 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile
Property Insights of 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile
The XLogP value of 1.73096 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile. The TPSA of 110.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile. Following Lipinski's Rule of Five, 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile has 1 hydrogen bond donor(s) and 5 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-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile?
The CAS number of 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile is 36938-00-8.
What is the molecular formula of 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile?
The molecular formula of 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile is C10H5N3O3.
What is the molecular weight of 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile?
The molecular weight of 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile is 215.03 g/mol.
Where can I buy 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile?
You can request a quote for 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5-Hydroxy-2-nitrophenyl)methylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.