![2-[Amino(methoxy)methylidene]propanedinitrile structure](/static/products/667/66718-78-3.png)
2-[Amino(methoxy)methylidene]propanedinitrile
TL;DR: 2-[Amino(methoxy)methylidene]propanedinitrile (CAS 66718-78-3) is a chemical compound with molecular formula C5H5N3O and molecular weight 123.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[amino(methoxy)methylidene]propanedinitrile
Also Known As: 2-(amino-methoxy-methylene)-malononitrile, 2-(amino-methoxy-methylidene)propanedinitrile, 2-[amino(methoxy)methylidene]propanedinitrile
| Molecular Formula | C5H5N3O |
|---|---|
| Molecular Weight | 123.04 g/mol |
| LogP | -0.14974 |
| Topological Polar Surface Area | 82.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 123.04326 |
| Heavy Atoms | 9 |
| Complexity | 189.22345 |
Chemical Identifiers
| CAS Number | 66718-78-3 |
|---|---|
| SMILES | COC(=C(C#N)C#N)N |
Product Overview
2-[Amino(methoxy)methylidene]propanedinitrile (CAS 66718-78-3), with molecular formula C5H5N3O and molecular weight 123.04 g/mol. IUPAC: 2-[amino(methoxy)methylidene]propanedinitrile.
Chemical Property Profile of 2-[Amino(methoxy)methylidene]propanedinitrile
Property Insights of 2-[Amino(methoxy)methylidene]propanedinitrile
The XLogP value of -0.14974 indicates that 2-[Amino(methoxy)methylidene]propanedinitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[Amino(methoxy)methylidene]propanedinitrile. Following Lipinski's Rule of Five, 2-[Amino(methoxy)methylidene]propanedinitrile 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-[Amino(methoxy)methylidene]propanedinitrile?
The CAS number of 2-[Amino(methoxy)methylidene]propanedinitrile is 66718-78-3.
What is the molecular formula of 2-[Amino(methoxy)methylidene]propanedinitrile?
The molecular formula of 2-[Amino(methoxy)methylidene]propanedinitrile is C5H5N3O.
What is the molecular weight of 2-[Amino(methoxy)methylidene]propanedinitrile?
The molecular weight of 2-[Amino(methoxy)methylidene]propanedinitrile is 123.04 g/mol.
Where can I buy 2-[Amino(methoxy)methylidene]propanedinitrile?
You can request a quote for 2-[Amino(methoxy)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(methoxy)methylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[Amino(methoxy)methylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.