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
1.9988 1.5519 0.9329 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6801 1.4709 0.9688 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1033 0.2496 1.5127 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6419 -0.5914 0.6493 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8757 -1.9014 1.3477 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0599 -2.9885 1.9047 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.3114 -0.4602 -0.5695 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4517 0.0085 -1.6471 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0893 -0.6818 -2.7005 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5556 2.4279 0.5464 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6710 0.7378 1.2638 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0631 2.2623 0.6276 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8501 -0.3273 2.0789 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6620 0.5273 2.3462 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6063 -1.5280 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2985 0.0864 -0.4911 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0698 1.0431 -1.5446 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4009 -1.6889 -2.8661 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5452 -0.1983 -3.4522 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