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
-2.5884 -0.1099 -1.6398 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3622 0.1218 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3828 -0.9404 -0.9014 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0541 -0.8762 0.4686 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8195 -1.1731 1.5019 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5484 -1.4155 2.3921 N 0 0 0 0 0 0 0 0 0 0 0 0
1.4163 -0.4709 0.7365 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5617 0.9868 0.4177 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9429 1.8626 1.3218 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2649 0.6994 -1.8587 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9489 -1.1176 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0209 1.1455 -1.0886 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8926 -1.9301 -1.0346 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4705 -0.9051 -1.6158 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7074 -0.6040 1.7835 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1236 -1.0079 0.0688 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3468 1.3424 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0485 2.9067 1.1076 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1569 1.4857 2.3284 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