Malononitrile, (2-hydroxy-3-methoxybenzylidene)-
TL;DR: Malononitrile, (2-hydroxy-3-methoxybenzylidene)- (CAS 36938-01-9) is a chemical compound with molecular formula C11H8N2O2 and molecular weight 200.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-hydroxy-3-methoxyphenyl)methylidene]propanedinitrile
Also Known As: MALONONITRILE, (2-HYDROXY-3-METHOXYBENZYLIDENE)-, (2-Hydroxy-3-methoxybenzylidene)malononitrile, 4-10-00-02305 (Beilstein Handbook Reference), 2-Hydroxy-3-methoxybenzylidenemalononitrile, (2-hydroxy-3-methoxy-benzylidene)-malononitrile
| Molecular Formula | C11H8N2O2 |
|---|---|
| Molecular Weight | 200.06 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 77.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.05858 |
| Heavy Atoms | 15 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 36938-01-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1O)C=C(C#N)C#N |
| InChIKey | FLKSNFNDQCADDI-UHFFFAOYSA-N |
Product Overview
Malononitrile, (2-hydroxy-3-methoxybenzylidene)- (CAS 36938-01-9), with molecular formula C11H8N2O2 and molecular weight 200.06 g/mol. IUPAC: 2-[(2-hydroxy-3-methoxyphenyl)methylidene]propanedinitrile.
Chemical Property Profile of Malononitrile, (2-hydroxy-3-methoxybenzylidene)-
Property Insights of Malononitrile, (2-hydroxy-3-methoxybenzylidene)-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Malononitrile, (2-hydroxy-3-methoxybenzylidene)-. The TPSA of 77.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Malononitrile, (2-hydroxy-3-methoxybenzylidene)-. Following Lipinski's Rule of Five, Malononitrile, (2-hydroxy-3-methoxybenzylidene)- has 1 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 Malononitrile, (2-hydroxy-3-methoxybenzylidene)-?
The CAS number of Malononitrile, (2-hydroxy-3-methoxybenzylidene)- is 36938-01-9.
What is the molecular formula of Malononitrile, (2-hydroxy-3-methoxybenzylidene)-?
The molecular formula of Malononitrile, (2-hydroxy-3-methoxybenzylidene)- is C11H8N2O2.
What is the molecular weight of Malononitrile, (2-hydroxy-3-methoxybenzylidene)-?
The molecular weight of Malononitrile, (2-hydroxy-3-methoxybenzylidene)- is 200.06 g/mol.
Where can I buy Malononitrile, (2-hydroxy-3-methoxybenzylidene)-?
You can request a quote for Malononitrile, (2-hydroxy-3-methoxybenzylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Malononitrile, (2-hydroxy-3-methoxybenzylidene)-?
Yes, KEHONG BIO provides custom synthesis services for Malononitrile, (2-hydroxy-3-methoxybenzylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.