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[(2-Methoxyanilino)methylene]malononitrile
TL;DR: [(2-Methoxyanilino)methylene]malononitrile (CAS 24115-30-8) is a chemical compound with molecular formula C11H9N3O and molecular weight 199.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methoxyanilino)methylidene]propanedinitrile
Also Known As: ZERO/003146, [(2-methoxyanilino)methylene]malononitrile, 2-[(2-methoxyanilino)methylidene]propanedinitrile, Propanedinitrile, 2-[[(2-methoxyphenyl)amino]methylene]-, 2-{[(2-METHOXYPHENYL)AMINO]METHYLIDENE}PROPANEDINITRILE
| Molecular Formula | C11H9N3O |
|---|---|
| Molecular Weight | 199.07 g/mol |
| LogP | 2.03816 |
| Topological Polar Surface Area | 68.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 199.07455 |
| Heavy Atoms | 15 |
| Complexity | 435.63623 |
Chemical Identifiers
| CAS Number | 24115-30-8 |
|---|---|
| SMILES | COC1=CC=CC=C1NC=C(C#N)C#N |
Product Overview
[(2-Methoxyanilino)methylene]malononitrile (CAS 24115-30-8), with molecular formula C11H9N3O and molecular weight 199.07 g/mol. IUPAC: 2-[(2-methoxyanilino)methylidene]propanedinitrile.
Chemical Property Profile of [(2-Methoxyanilino)methylene]malononitrile
Property Insights of [(2-Methoxyanilino)methylene]malononitrile
The XLogP value of 2.03816 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(2-Methoxyanilino)methylene]malononitrile. The TPSA of 68.84 Ų falls within the moderate polarity range, balancing permeability and solubility for [(2-Methoxyanilino)methylene]malononitrile. Following Lipinski's Rule of Five, [(2-Methoxyanilino)methylene]malononitrile 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 [(2-Methoxyanilino)methylene]malononitrile?
The CAS number of [(2-Methoxyanilino)methylene]malononitrile is 24115-30-8.
What is the molecular formula of [(2-Methoxyanilino)methylene]malononitrile?
The molecular formula of [(2-Methoxyanilino)methylene]malononitrile is C11H9N3O.
What is the molecular weight of [(2-Methoxyanilino)methylene]malononitrile?
The molecular weight of [(2-Methoxyanilino)methylene]malononitrile is 199.07 g/mol.
Where can I buy [(2-Methoxyanilino)methylene]malononitrile?
You can request a quote for [(2-Methoxyanilino)methylene]malononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(2-Methoxyanilino)methylene]malononitrile?
Yes, KEHONG BIO provides custom synthesis services for [(2-Methoxyanilino)methylene]malononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.