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
-2.2961 -2.0797 1.0608 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7127 -0.8953 0.9979 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2467 -0.8493 0.8389 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0794 -0.1435 -0.3755 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2281 -0.6388 -1.6283 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4913 -1.0845 -2.6995 N 0 0 0 0 0 0 0 0 0 0 0 0
0.7751 1.1535 -0.3184 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1230 1.6008 -1.6796 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3302 1.8295 -2.1139 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7102 -3.0088 0.9964 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3597 -2.2453 1.1752 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2800 0.0035 1.0594 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1949 -1.8692 0.7391 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1838 -0.3772 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6099 1.1519 0.3986 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0014 1.8402 0.1452 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2870 1.7451 -2.3823 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5051 2.1564 -3.1277 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2347 1.7107 -1.5145 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