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
1.6316 -1.8014 0.3674 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9539 -0.8789 1.0317 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0469 0.5604 0.7286 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1913 1.1989 0.3745 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.1537 2.5858 0.0856 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1374 3.7165 -0.1644 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.4364 0.4980 0.2957 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5758 -0.4339 -0.8453 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6297 -0.5872 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5684 -2.8613 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2792 -1.4954 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3076 -1.2135 1.8281 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4606 1.1339 1.6098 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8463 0.7239 -0.0597 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2898 1.2413 0.2515 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6648 -0.0450 1.2695 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4918 -1.0130 -0.9493 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8169 -1.3006 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2930 -0.0287 -1.6775 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