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
-1.7496 0.3688 1.7902 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7605 -0.3388 0.6672 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2017 0.2028 -0.5883 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1247 -0.5863 -1.1123 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3102 -1.8708 -1.6214 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4787 -2.9573 -2.0556 N 0 0 0 0 0 0 0 0 0 0 0 0
1.2291 -0.0411 -1.1223 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6801 0.0669 0.2798 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0115 1.2488 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1554 -0.0106 2.7251 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3142 1.3608 1.7503 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2028 -1.3401 0.7226 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9809 0.3234 -1.3744 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8335 1.2285 -0.3864 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9027 -0.6729 -1.7336 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2503 0.9654 -1.5748 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7481 -0.7915 0.9181 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9530 2.1548 0.1427 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3372 1.3004 1.8000 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