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
-2.0838 1.3076 0.9107 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7953 0.1814 0.3408 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9794 -0.1314 -0.8281 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1994 -0.9211 -0.3106 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0765 -2.0647 0.4613 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3049 -2.9917 1.0647 N 0 0 0 0 0 0 0 0 0 0 0 0
1.5264 -0.7411 -0.8161 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3382 0.4432 -0.8111 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4434 1.5096 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2421 2.2134 1.2672 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9694 0.7837 1.7967 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2732 -0.7802 0.8133 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5306 -0.7950 -1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5810 0.7593 -1.3557 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4210 -1.0978 -1.9172 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1276 -1.6325 -0.3871 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1780 0.7914 -1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7235 0.8007 0.1678 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8788 2.3654 0.0049 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