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
-1.4314 3.0209 -1.1662 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3744 1.7122 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0863 1.0374 -0.7549 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1760 0.3020 0.4872 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3065 0.9817 1.7013 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4265 1.5277 2.7088 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.1229 -1.1230 0.4818 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2187 -1.6373 0.0901 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9879 -2.3833 0.8217 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5409 3.6261 -1.0389 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3512 3.5346 -1.3811 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2865 1.1341 -1.1896 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2189 0.3576 -1.5852 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6940 1.8317 -0.7125 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8381 -1.6087 -0.2302 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3480 -1.5779 1.4685 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5440 -1.3396 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9417 -2.7087 0.4589 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6833 -2.6940 1.8075 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