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
-2.3500 -0.3772 -0.0523 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5275 0.6293 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1314 0.4721 -0.0323 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5385 -0.7960 -0.3324 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9399 -0.5132 0.1562 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0939 0.8856 -0.0021 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8736 1.4972 0.1054 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6469 2.7036 0.2870 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4165 -0.2850 0.0386 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9198 -1.3417 -0.2753 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9317 1.5974 0.3159 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0270 -1.5617 0.2915 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4783 -1.0643 -1.3862 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7026 -1.0504 -0.4389 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9763 -0.7956 1.2308 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