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
0.6878 1.1903 1.7872 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4420 1.4928 1.2413 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8607 1.1529 -0.1107 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1629 0.4742 -0.9270 N 0 0 0 0 0 0 0 0 0 0 0 0
1.2139 1.2520 -1.3219 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1615 1.9386 -1.6569 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0474 -0.9272 -1.1829 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3012 -1.6828 0.0599 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5349 -2.3707 0.7557 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9646 1.4614 2.7936 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4742 0.6073 1.2619 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1638 2.0650 1.8467 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0997 2.1417 -0.6258 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7583 0.4977 -0.1305 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4725 -1.3201 -2.0604 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1642 -1.0241 -1.3346 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3829 -1.6170 0.3327 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1747 -2.8798 1.6399 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5757 -2.4522 0.4995 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