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
2.5497 -0.5714 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4476 0.1073 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1997 -0.5829 0.2499 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6803 0.7675 -0.5095 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8776 0.7724 0.2835 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9810 -0.5053 0.8485 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9260 -1.2055 0.2995 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1089 -2.4324 -0.1263 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5282 -0.1389 0.6039 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4788 -1.6001 0.9659 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6698 1.0826 -0.1488 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0481 1.5199 -0.3329 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6216 0.3581 -1.5029 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8314 0.8782 -0.3526 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8948 1.5505 1.0507 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