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
2.2961 -0.3410 -0.6259 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5323 -0.5574 0.4509 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1682 -0.2372 0.4663 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5891 0.3512 -0.6334 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9428 0.6652 -0.0749 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9543 0.0808 1.2152 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7282 -0.4241 1.5486 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3958 -0.9762 2.6297 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8554 0.0929 -1.5127 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3450 -0.5970 -0.6113 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9928 -0.9918 1.3263 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0911 1.2799 -0.9418 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6203 -0.3391 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7751 0.2176 -0.6867 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0931 1.7761 -0.0270 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