![2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile structure](/static/products/1022/102266-69-3.webp)
2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile
TL;DR: 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile (CAS 102266-69-3) is a chemical compound with molecular formula C13H7N3O2 and molecular weight 237.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[amino-(2-oxochromen-3-yl)methylidene]propanedinitrile
Also Known As: 2-[amino(2-oxo-2H-chromen-3-yl)methylidene]propanedinitrile, 2-[amino-(2-oxochromen-3-yl)methylidene]propanedinitrile, 2-[amino(2-oxo-2H-chromen-3-yl)methylene]malononitrile, 2-Amino(2-oxo-2H-chromen-3-yl)methylenemalononitrile, (AMINO(2-OXO(2H-CHROMEN-3-YL))METHYLENE)METHANE-1,1-DICARBONITRILE
| Molecular Formula | C13H7N3O2 |
|---|---|
| Molecular Weight | 237.05 g/mol |
| LogP | 1.50996 |
| Topological Polar Surface Area | 103.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.05383 |
| Heavy Atoms | 18 |
| Complexity | 772.2141 |
Chemical Identifiers
| CAS Number | 102266-69-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C(=C(C#N)C#N)N |
Product Overview
2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile (CAS 102266-69-3), with molecular formula C13H7N3O2 and molecular weight 237.05 g/mol. IUPAC: 2-[amino-(2-oxochromen-3-yl)methylidene]propanedinitrile.
Chemical Property Profile of 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile
Property Insights of 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile
The XLogP value of 1.50996 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile. The TPSA of 103.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile. Following Lipinski's Rule of Five, 2-[Amino-(2-oxochromen-3-yl)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-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile?
The CAS number of 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile is 102266-69-3.
What is the molecular formula of 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile?
The molecular formula of 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile is C13H7N3O2.
What is the molecular weight of 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile?
The molecular weight of 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile is 237.05 g/mol.
Where can I buy 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile?
You can request a quote for 2-[Amino-(2-oxochromen-3-yl)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-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[Amino-(2-oxochromen-3-yl)methylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.