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
-2.7272 -0.0563 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0598 -0.8350 -0.6966 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4762 -0.2540 0.5391 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0429 -0.3890 0.5796 N 0 0 0 0 0 0 0 0 0 0 0 0
0.6087 -1.5969 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1788 -2.6377 0.8659 N 0 0 0 0 0 0 0 0 0 0 0 0
0.7458 0.8270 0.4552 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2208 0.5157 0.4202 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9544 0.8587 -0.6162 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8568 1.0094 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1503 -0.4750 -2.4221 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9463 -1.8697 -0.9199 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7877 0.8136 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9437 -0.7747 1.4218 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6344 1.4824 1.3649 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4840 1.3711 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6692 0.0033 1.2583 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0058 0.6261 -0.6213 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4890 1.3809 -1.4671 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