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
2.3277 -0.5568 -0.1969 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5382 0.4995 -0.1051 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1594 0.4283 0.1363 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5926 -0.7939 0.3183 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9318 -0.3713 -0.2468 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0687 0.9194 0.3676 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7859 1.4802 0.2551 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5673 2.7191 0.2641 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3714 -0.4245 -0.3829 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9325 -1.5483 -0.0865 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9666 1.5091 -0.2219 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1572 -1.6549 -0.2027 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6583 -0.9532 1.4252 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7894 -0.2084 -1.3299 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7445 -1.0443 0.0060 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