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
2.3093 2.2735 -1.1747 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2055 1.4915 -1.2718 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1247 0.1438 -0.7234 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1779 -0.0865 0.3202 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4874 0.4074 1.6516 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7295 0.7881 2.6357 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.1016 -0.6613 0.0416 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7751 -1.1817 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3163 -2.2859 1.5814 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2501 3.2127 -1.6075 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1343 1.8186 -0.6581 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3649 1.8834 -1.8407 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8735 -0.5494 -1.5785 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1324 -0.2225 -0.3506 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9200 -1.4534 -0.7494 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6872 0.1433 -0.4794 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8415 -0.3815 2.0373 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7136 -2.1922 2.6402 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4342 -3.1477 1.0295 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