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
-2.7467 -0.0225 1.6612 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9286 0.8205 1.0204 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4758 0.8120 1.3308 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3073 0.4897 0.0993 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3132 1.4391 -0.9051 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3380 2.2548 -1.7720 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9435 -0.7494 0.1001 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7625 -1.2419 -0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1016 -0.7123 -2.1163 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3547 -0.6928 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8051 -0.0533 1.4706 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3740 1.4833 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2683 0.0451 2.0584 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1670 1.8350 1.6451 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0849 -1.5239 0.2108 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4879 -0.8704 1.1127 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1876 -2.2715 -0.7856 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7619 -1.2818 -2.8151 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8318 0.2401 -2.5176 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