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
0.8859 2.2820 -0.9919 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9739 1.5337 0.0994 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6190 0.2073 0.0787 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7197 -0.8137 0.4949 N 0 0 0 0 0 0 0 0 0 0 0 0
1.2467 -2.1409 0.5198 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6771 -3.2057 0.5586 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6375 -0.5959 0.8728 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5581 -0.2210 -0.2331 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5869 -1.0275 -0.4749 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4005 3.2757 -0.9667 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2920 1.9103 -1.9252 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5572 1.9222 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1000 -0.0099 -0.9052 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5004 0.2411 0.7997 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0462 -1.5354 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7169 0.2320 1.6555 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4069 0.6826 -0.8242 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3054 -0.8297 -1.2608 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7145 -1.9072 0.1279 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