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
-2.2848 -0.8919 1.7192 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5515 -0.7872 0.5999 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3901 0.5323 -0.0227 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0489 1.0161 -0.1203 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1312 2.3325 -0.6024 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2646 3.4091 -0.9941 N 0 0 0 0 0 0 0 0 0 0 0 0
1.1067 0.2336 0.2044 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4034 -0.8303 -0.7829 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6075 -0.7799 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4297 -1.8354 2.2082 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7510 0.0065 2.1545 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1392 -1.7165 0.2428 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9269 1.2879 0.6343 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9234 0.5576 -1.0091 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0182 -0.2426 1.2176 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0198 0.8975 0.2764 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7209 -1.6430 -1.0532 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3195 -0.0092 -1.1731 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8537 -1.5370 -2.1094 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