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
2.3595 1.2211 1.7124 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8863 0.0469 1.4023 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5511 -0.2350 -0.0322 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1340 -0.5050 -0.1540 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3864 -1.6483 0.4161 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8231 -2.6094 0.9151 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6865 0.4300 -0.8826 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1343 0.1237 -0.7196 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9098 -0.1681 -1.7306 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5982 1.4209 2.7357 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5021 1.9797 0.9698 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7262 -0.7232 2.1504 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9313 0.5491 -0.6799 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0795 -1.1880 -0.2888 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3910 0.2642 -1.9649 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4354 1.4772 -0.6643 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5622 0.1476 0.2687 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4756 -0.1878 -2.7459 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9640 -0.3957 -1.6402 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