31164-08-6

Basic information

• Product Name: 3-(diprop-2-enylamino)propanenitrile
• Synonyms: 3-(diprop-2-enylamino)propanenitrile
• CAS NO: 31164-08-6
• Molecular Formula: C9H14N2
• Molecular Weight: 150.2209
• Mol File: 31164-08-6.mol
• Article Data: 3

Chemical Properties

• Boiling Point: 250.9°Cat760mmHg
• Flash Point: 97.2°C
• Appearance: /
• Density: 0.894g/cm³
• Vapor Pressure: 0.0211mmHg at 25°C
• Refractive Index: 1.469
• CAS DataBase Reference: 3-(diprop-2-enylamino)propanenitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(diprop-2-enylamino)propanenitrile(31164-08-6)
• EPA Substance Registry System: 3-(diprop-2-enylamino)propanenitrile(31164-08-6)

Safety Data

• Hazardous Substances Data: 31164-08-6(Hazardous Substances Data)

Usage

InChI:InChI=1/C9H14N2/c1-3-7-11(8-4-2)9-5-6-10/h3-4H,1-2,5,7-9H2

Upstream product

• 5164-11-4 N,N-diallyl-hydrazine 
• 107-02-8 acrolein 
• 107-13-1 acrylonitrile 
• 124-02-7 diallylamine 

Downstream Products

• 43036-06-2 3-(pyrrol-1-yl)propanenitrile 

Relevant articles and documents

π-Complexes of copper(I) halides with 3-(allylamino)-(C3H 5NHC2H4CN, Apn) and 3-(diallylamino)-((C3H 5)2NC2H4CN, dapn)-propanenitrile. Syntheses and crystal structures of compounds [CuCl(Apn)], [(H+Apn)Cu2Cl 3], [(H+dapn)CuCl2], and [(H+dapn)CuBr2]

The π-complexes [CuCl(C3H5NHC2H4CN)] (I), [(C 3H5NH2C2H4CN)Cu2Cl3] (II), [((C3H5)2NHC2H 4CN)CuCl2] (III), and [((C3H5)2NHC2H4CN)CuBr2] (IV) are obtained as single crystals by the ac electrochemical synthesis on copper wire electrodes from ethanolic solutions of 3-(allylamino)propanenitrile, 3-(diallylamino)propanenitrile, and CuX2 (X = Cl, Br). Their crystal structures are determined. The crystals of compounds I, III, and IV are monoclinic, space group P21/c, Z = 4. The crystals of compound II are triclinic, space group P1, Z = 2. The unit cell parameters are a = 11.125(4), b = 8.769(4), c = 8.570(4) A, β = 90.94(4)°, V = 835.9(6) A3 (I); a = 6.2566(4), b = 7.5975(6), c = 11.1251(8) A, α = 90.896(6)°, β = 92.827(5)°, γ = 94.340(5)°, V = 526.57(7) A3 (II); a= 11.656(4), b= 6.992(4), c = 14.681(5) A, β = 100.89(4)°, V = 1174.9(9) A3 (III); a = 11.845(4), b = 7.282(4), c= 14.855(5) A, β = 100.37(4)°, V = 1260.4(9) A3 (IV). The coordination mode of the Cu(I) atom in complex I includes two halogen atoms, the C=C bond, and the secondary amine N atom. The coordination environment in isostructural crystals of complexes III and IV is formed by the C=C bond and three halogen atoms as in complex II. Pleiades Publishing, Ltd., 2012.

Iodine-alumina catalyzed Aza- michael addition under solvent free conditions

An efficient aza-Michael addition of amines to a variety of activated olefins was carried out under solvent free conditions using iodine-alumina as a catalyst at room temperature or under microwave irradiation (in case of solid) in high yield. 2009 Bentham Science Publishers Ltd.