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
-3.1651 0.0261 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8804 0.2486 0.6453 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0471 0.9112 -0.4538 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0346 0.0711 -0.8988 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5205 -1.1438 -1.7377 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8578 -1.9979 -2.3052 N 0 0 0 0 0 0 0 0 0 0 0 0
1.3610 0.1410 -0.9704 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2447 0.3875 0.1778 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9804 -0.6358 0.6139 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7825 0.2538 -0.3726 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7762 -0.4696 1.2786 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4106 -0.0421 1.5562 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7442 1.2934 -1.2491 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6107 1.8561 -0.0267 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6566 0.7874 -1.8819 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7867 -0.8741 -1.4402 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2959 1.3734 0.6243 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6630 -0.5843 1.4122 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8413 -1.6018 0.0850 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