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
-2.7659 0.2801 -0.7868 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8903 -0.7067 -0.7867 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4272 -0.4147 -0.9321 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2748 -0.9136 0.2629 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3696 -2.2887 0.4729 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4365 -3.4519 0.6350 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8407 -0.0222 1.2215 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9815 0.7001 0.6352 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9224 2.0138 0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4097 1.2902 -0.8941 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8242 0.1192 -0.6818 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2186 -1.7305 -0.6822 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0019 -0.9257 -1.8367 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2382 0.6656 -1.0853 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0771 0.6606 1.6592 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2426 -0.6277 2.0789 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8504 0.1877 0.2708 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7271 2.6142 0.1446 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0534 2.5504 0.9205 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