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
-0.4139 0.5843 2.3025 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5604 -0.2859 2.3236 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2182 -0.7630 1.1091 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6743 -0.1251 -0.0564 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9146 1.2595 -0.2808 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1135 2.3736 -0.4689 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.1357 -0.8426 -1.0422 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4620 0.0251 -2.1777 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6648 0.3846 -2.5717 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9114 0.9461 3.2175 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7908 0.9922 1.3852 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9087 -0.6841 3.2695 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1080 -1.8738 1.0568 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3105 -0.4891 1.1438 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5179 -1.7107 -1.3553 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0138 -1.2957 -0.5589 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4129 0.3985 -2.7482 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7767 1.0393 -3.4386 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5699 0.0666 -2.0849 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