Monomers
Diallylcyanamide
Identifiers
IUPAC name
bis(prop-2-enyl)cyanamide
InchI
InChI=1S/C7H10N2/c1-3-5-9(7-8)6-4-2/h3-4H,1-2,5-6H2
InchI Key
ZOSAYFDMPYAZTB-UHFFFAOYSA-N
SMILES
C=CCN(C#N)CC=C
Canonical SMILES
C=CCN(CC=C)C#N
Isomeric SMILES
C=CCN(CC=C)C#N
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C7H10N2
Heavy Atom Count
9
Molecular Weight
122.171
Exact Molecular Weight
122.0844
Valence Electrons
48
Radical Electrons
0
tPSA
27.03
MolLogP
1.1415
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
19 18 0 0 0 0 0 0 0 0999 V2000
-1.8973 -0.9430 -2.1897 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5812 -1.3578 -1.0071 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2753 -0.3134 0.0212 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0502 -0.4884 0.5753 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1356 -1.6370 1.4244 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2254 -2.5866 2.1185 N 0 0 0 0 0 0 0 0 0 0 0 0
1.1887 0.3299 0.3343 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1474 1.6795 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1006 2.0153 1.7992 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1294 -1.6587 -2.9927 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9505 0.1026 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5344 -2.3847 -0.7332 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0120 -0.4549 0.8346 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3164 0.7087 -0.3993 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1086 -0.1851 0.6878 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3462 0.4976 -0.7749 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3703 2.3730 0.6547 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8790 1.3195 2.0647 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1445 2.9834 2.2817 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 1 0
4 5 1 0
5 6 3 0
4 7 1 0
7 8 1 0
8 9 2 3
1 10 1 0
1 11 1 0
2 12 1 0
3 13 1 0
3 14 1 0
7 15 1 0
7 16 1 0
8 17 1 0
9 18 1 0
9 19 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers