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
1.9239 -1.4347 -0.0084 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4664 -0.3811 -0.6387 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1556 0.1337 -0.4377 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8646 -0.3840 0.4549 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5620 0.8865 0.8781 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5905 1.5990 -0.3537 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4310 1.2643 -1.0693 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0481 1.8207 -2.0831 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3541 -2.0027 0.7136 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9271 -1.7962 -0.1882 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1118 0.1220 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4270 -0.9445 1.2993 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6272 -0.9878 -0.0971 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9063 1.4040 1.6004 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5784 0.7007 1.2741 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