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
2.3440 0.3656 -0.1959 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5310 -0.4712 0.4159 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1269 -0.2670 0.3948 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5769 0.8191 -0.2585 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8705 0.0917 -0.6477 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1344 -0.6138 0.5526 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8847 -1.0656 0.9976 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6889 -2.0313 1.8075 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4152 0.2568 -0.2106 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9325 1.2155 -0.7181 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9934 -1.3035 0.9226 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0638 1.2232 -1.1304 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8963 1.6009 0.4695 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5678 -0.6042 -1.4716 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6595 0.7841 -0.9279 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