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
-2.0798 -0.4255 -1.3527 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9093 -0.1765 -0.0604 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9027 0.8560 0.3803 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1012 0.2419 1.2288 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2824 -0.2170 2.4909 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5943 -0.5786 3.5421 N 0 0 0 0 0 0 0 0 0 0 0 0
1.4518 0.1303 0.7221 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5339 -0.8363 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9497 -0.4012 -1.5709 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5215 0.0853 -2.1185 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8162 -1.1760 -1.6164 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4579 -0.6783 0.7063 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4630 1.3784 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4607 1.5683 1.0481 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0728 -0.2682 1.5516 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8406 1.1093 0.4253 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2703 -1.8796 -0.3071 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2380 0.6405 -1.7545 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0296 -1.0626 -2.4291 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