![3-[2-Cyanoethyl-(6-nitro-1,3-benzothiazol-2-yl)amino]propanenitrile structure](/static/products/3006/300686-13-9.webp)
3-[2-Cyanoethyl-(6-nitro-1,3-benzothiazol-2-yl)amino]propanenitrile
3-[2-cyanoethyl-(6-nitro-1,3-benzothiazol-2-yl)amino]propanenitrile
Also Known As: BAS 00398606|3-[2-cyanoethyl-(6-nitro-1,3-benzothiazol-2-yl)amino]propanenitrile|AG-690/09704051|3-[(2-cyanoethyl)(6-nitrobenzothiazol-2-yl)amino]propanenitrile|SR-01000310936-1|3-((2-cyanoethyl){6-nitro-1,3-benzothiazol-2-yl}amino)propanenitrile|3-[(2-Cyano-ethyl)-(6-nitro-benzothiazol-2-yl)-amino]-propionitrile
| Molecular Formula | C13H11N5O2S |
|---|---|
| Molecular Weight | 301.06335 g/mol |
| LogP | 2.83826 |
| Topological Polar Surface Area | 106.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 301.06335 |
| Monoisotopic Mass | 301.06335 |
| Heavy Atoms | 21 |
| Complexity | 725.0801 |
Chemical Identifiers
| CAS Number | 300686-13-9 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)N(CCC#N)CCC#N |
Product Overview
3-[2-Cyanoethyl-(6-nitro-1,3-benzothiazol-2-yl)amino]propanenitrile (CAS 300686-13-9), with molecular formula C13H11N5O2S and molecular weight 301.06335 g/mol. IUPAC: 3-[2-cyanoethyl-(6-nitro-1,3-benzothiazol-2-yl)amino]propanenitrile.
3-[2-Cyanoethyl-(6-nitro-1,3-benzothiazol-2-yl)amino]propanenitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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