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
-2.8969 1.0025 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8037 0.4704 -0.9298 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3426 -0.8597 -0.5118 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0237 -0.8373 0.0821 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5286 -2.0410 0.5198 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0102 -3.0459 0.8904 N 0 0 0 0 0 0 0 0 0 0 0 0
0.6826 0.4004 0.2092 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0113 0.2615 0.8332 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0951 0.6176 0.1839 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2510 1.9810 -0.7256 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5115 0.4869 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2417 1.0294 -1.6611 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0961 -1.2798 0.1982 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2838 -1.5706 -1.3817 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8168 0.8242 -0.8119 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1303 1.1585 0.8052 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0826 -0.1355 1.8286 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0932 0.5219 0.6316 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0004 1.0157 -0.8188 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