Monomers
1,3-Divinylimidazolidin-2-one
Identifiers
IUPAC name
1,3-bis(ethenyl)imidazolidin-2-one
InchI
InChI=1S/C7H10N2O/c1-3-8-5-6-9(4-2)7(8)10/h3-4H,1-2,5-6H2
InchI Key
HMYBDZFSXBJDGL-UHFFFAOYSA-N
SMILES
C=CN1CCN(C1=O)C=C
Canonical SMILES
C=CN1CCN(C1=O)C=C
Isomeric SMILES
C=CN1CCN(C1=O)C=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C7H10N2O
Heavy Atom Count
10
Molecular Weight
138.17
Exact Molecular Weight
138.0793
Valence Electrons
54
Radical Electrons
0
tPSA
23.55
MolLogP
1.011
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0
MOL File
RDKit 3D
20 20 0 0 0 0 0 0 0 0999 V2000
-3.4487 -0.5971 0.2043 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4802 -0.0547 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1433 -0.0291 0.4697 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6931 -0.5759 -0.7887 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8196 -0.5421 -0.7472 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1579 0.3335 0.3551 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0266 0.5169 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0443 1.0891 2.2635 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4159 0.9264 0.6487 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4188 0.6773 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4699 -0.6175 0.5475 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1958 -1.0295 -0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7280 0.3781 1.8764 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1090 0.0226 -1.6221 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0752 -1.6207 -0.9161 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1797 -1.5691 -0.6241 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1613 -0.0556 -1.6805 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5420 1.5742 1.5185 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3313 0.0458 -1.0115 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3877 1.1273 0.0687 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 1 0
6 7 1 0
7 8 2 0
6 9 1 0
9 10 2 3
7 3 1 0
1 11 1 0
1 12 1 0
2 13 1 0
4 14 1 0
4 15 1 0
5 16 1 0
5 17 1 0
9 18 1 0
10 19 1 0
10 20 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers