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
2.6733 -0.4871 0.2507 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3672 0.4690 -0.5409 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0043 1.0524 -0.7546 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0245 0.4276 0.0712 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1353 0.6388 1.5165 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2014 0.8058 2.5923 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0411 -0.3661 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8596 -0.8088 0.7589 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1348 -0.4872 0.8614 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0038 -1.0137 0.8779 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7264 -0.8444 0.3367 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1758 0.9295 -1.1458 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9824 2.1406 -0.5815 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7609 0.8214 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6539 -1.3303 -0.8569 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6938 0.1894 -1.1425 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3435 -1.4075 1.5274 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6265 0.0949 0.1082 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7020 -0.8245 1.7446 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