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
3.0971 0.7631 0.1034 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3354 -0.2882 0.2995 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1099 -0.1754 1.1082 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1139 -0.5059 0.4067 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3962 -1.8079 0.0059 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6380 -2.8820 -0.3213 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0523 0.5817 0.1076 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3271 0.0881 -0.3949 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8411 0.3557 -1.5613 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0017 0.7320 -0.4759 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8094 1.7386 0.5233 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6117 -1.2517 -0.1379 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0538 0.8220 1.5412 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1846 -0.8656 1.9961 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5546 1.2478 -0.6204 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1396 1.1407 1.0643 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9034 -0.5728 0.2825 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4128 0.9796 -2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8246 -0.1000 -1.8088 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