Monomers
3-Vinyloxazolidin-2-one
Identifiers
IUPAC name
3-ethenyl-1,3-oxazolidin-2-one
InchI
InChI=1S/C5H7NO2/c1-2-6-3-4-8-5(6)7/h2H,1,3-4H2
InchI Key
VUEZBQJWLDBIDE-UHFFFAOYSA-N
SMILES
C=CN1CCOC1=O
Canonical SMILES
C=CN1CCOC1=O
Isomeric SMILES
C=CN1CCOC1=O
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7NO2
Heavy Atom Count
8
Molecular Weight
113.116
Exact Molecular Weight
113.0477
Valence Electrons
44
Radical Electrons
0
tPSA
29.54
MolLogP
0.5821
H Bond Acceptors
2
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
15 15 0 0 0 0 0 0 0 0999 V2000
2.3697 -0.4941 -0.2222 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5932 0.5463 -0.0347 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1720 0.4516 -0.0088 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5812 -0.7570 -0.1791 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0426 -0.3770 -0.0969 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0569 1.0146 0.1244 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7444 1.5174 0.1869 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4129 2.7132 0.3832 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4354 -0.3826 -0.2352 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9573 -1.4775 -0.3665 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0901 1.5202 0.1057 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3638 -1.4236 0.6775 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3396 -1.2840 -1.1212 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5250 -0.6807 -1.0362 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5514 -0.8868 0.7735 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
7 3 1 0
1 9 1 0
1 10 1 0
2 11 1 0
4 12 1 0
4 13 1 0
5 14 1 0
5 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers