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
1.4935 -2.6963 -0.5826 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4840 -2.0039 -0.0997 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5503 -0.9981 0.9845 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1035 0.2941 0.5428 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0705 1.2684 1.5474 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2044 2.0814 2.3952 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.1239 0.6048 -0.8299 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6466 1.9794 -0.9763 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8398 2.1949 -1.5409 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5099 -2.5463 -0.1695 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3769 -3.4189 -1.3647 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5166 -2.1788 -0.5375 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0646 -1.3656 1.9106 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6529 -0.9265 1.2434 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8723 -0.1110 -1.2372 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8285 0.4795 -1.4315 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0777 2.8294 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2708 3.1725 -1.6738 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4414 1.3410 -1.8926 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