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
2.3928 0.4720 -1.0673 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9721 -0.6842 -0.5768 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8508 -0.8039 0.3659 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2585 0.4739 0.7000 N 0 0 0 0 0 0 0 0 0 0 0 0
0.9251 1.4250 1.4488 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4819 2.2155 2.0814 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0800 0.7470 0.2229 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0801 -0.1253 0.9218 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7982 -0.9464 0.1746 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9177 1.4131 -0.7897 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2177 0.5358 -1.7584 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4586 -1.6175 -0.8649 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2487 -1.2988 1.3011 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0621 -1.5084 0.0062 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3340 1.8261 0.4275 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0757 0.5508 -0.8654 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2001 -0.0796 1.9846 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5254 -1.5839 0.6521 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6927 -1.0113 -0.8981 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