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
-2.5684 -0.9857 -0.2279 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4128 0.3029 -0.2646 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2752 1.1777 -0.3677 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0490 0.6941 -0.4099 N 0 0 0 0 0 0 0 0 0 0 0 0
1.0340 1.7049 -0.7072 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8362 2.5236 -0.9695 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5771 -0.6114 -0.1909 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0942 -0.5716 -0.2111 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7863 -0.8908 0.8657 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7480 -1.6662 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5558 -1.4751 -0.1408 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4006 0.8677 -0.1906 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4176 1.7494 -1.3586 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3724 1.9618 0.4598 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3114 -1.0978 0.7445 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3434 -1.3170 -1.0401 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6468 -0.2933 -1.0869 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8583 -0.8996 0.9563 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2141 -1.1736 1.7558 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