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
-2.3027 1.2590 0.4297 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6069 0.2490 0.9089 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3151 -0.9140 0.0692 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0866 -1.2046 -0.1154 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3861 -2.2943 -0.9021 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6599 -3.2386 -1.6059 N 0 0 0 0 0 0 0 0 0 0 0 0
1.1705 -0.4219 0.4641 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3125 0.9188 -0.1446 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4306 1.3009 -0.7359 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5216 2.1227 1.0406 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6881 1.2838 -0.5838 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2599 0.2887 1.9246 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8052 -0.7806 -0.9398 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8431 -1.7984 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8839 -0.3199 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0946 -1.0044 0.4532 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4907 1.6053 -0.1068 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2983 0.6556 -0.8056 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5288 2.2930 -1.1834 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