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
2.5124 0.0489 0.0852 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2384 0.0433 -0.0196 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4847 -0.9684 0.2908 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7688 -0.6618 0.0725 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7401 0.6289 -0.4018 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4999 1.0251 -0.4441 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6088 -1.3271 0.2478 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6176 1.2111 -0.6903 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