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
-2.5989 1.0930 0.4556 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2704 -0.0722 -0.0306 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0314 -0.0233 -0.9557 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0317 -0.8347 -0.2801 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0353 -2.1774 -0.3878 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0855 -3.4839 -0.5098 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8582 -0.1724 0.5782 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7946 0.7407 -0.3246 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1351 0.3906 -0.1057 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0747 1.9912 0.2293 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4377 1.2448 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7211 -0.9791 0.2104 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4000 -0.4047 -1.8933 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6771 0.9827 -1.1224 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5029 -0.7408 1.2058 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3111 0.6269 1.1533 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4302 1.4752 -0.9368 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1608 -0.4219 0.6348 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9293 0.7653 -0.5515 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