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
2.2060 2.0883 0.0058 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3732 1.4175 0.7973 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4464 -0.0499 1.0175 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2330 -0.7166 0.6181 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0565 -2.0890 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1011 -3.2361 0.9239 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8280 0.0456 0.0156 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0406 -0.7540 -0.2396 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4847 -0.9024 -1.4668 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1351 3.1457 -0.1381 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9706 1.5024 -0.4917 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5888 1.9544 1.3206 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6196 -0.1956 2.1189 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3458 -0.4027 0.4672 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4698 0.4226 -0.9742 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1292 0.9218 0.6445 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6030 -1.2421 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3684 -1.4772 -1.7053 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9503 -0.4327 -2.2752 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