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
-3.0598 -0.0481 -0.9063 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7916 -0.0245 -0.8128 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3857 0.0018 -0.7091 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0466 0.2133 0.6818 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3596 1.4594 1.2969 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7305 2.5275 1.8298 N 0 0 0 0 0 0 0 0 0 0 0 0
0.7723 -0.7725 1.4042 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2359 -0.8560 0.9705 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6344 0.0175 0.0962 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5980 0.6997 -1.6358 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6972 -0.7080 -0.3786 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7727 1.0904 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0232 -1.0823 -0.9557 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2367 0.6186 -1.3619 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7006 -0.6210 2.4742 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3559 -1.8185 1.1383 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8309 -1.6244 1.4152 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6262 0.1152 -0.3573 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9791 0.8119 -0.1619 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