Monomers
Vinylene carbonate
Identifiers
IUPAC name
1,3-dioxol-2-one
InchI
InChI=1S/C3H2O3/c4-3-5-1-2-6-3/h1-2H
InchI Key
VAYTZRYEBVHVLE-UHFFFAOYSA-N
SMILES
O=c1occo1
Canonical SMILES
C1=COC(=O)O1
Isomeric SMILES
C1=COC(=O)O1
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C3H2O3
Heavy Atom Count
6
Molecular Weight
86.046
Exact Molecular Weight
86.0004
Valence Electrons
32
Radical Electrons
0
tPSA
43.35
MolLogP
0.2328
H Bond Acceptors
3
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
8 8 0 0 0 0 0 0 0 0999 V2000
2.5141 0.0371 -0.0315 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2636 -0.0215 -0.0208 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4843 -1.0518 0.1011 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7695 -0.6767 0.0615 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7369 0.6931 -0.0975 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5182 1.0324 -0.1407 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6491 -1.3268 0.1396 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6248 1.3142 -0.1667 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 1 0
4 5 2 0
5 6 1 0
6 2 1 0
4 7 1 0
5 8 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers