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
2.3891 -0.0572 -0.8186 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2038 -0.0344 -0.4635 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4805 -1.0594 -0.1471 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7219 -0.6681 0.1778 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7164 0.7013 0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4977 1.0461 -0.3542 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5625 -1.2586 0.4879 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5702 1.3303 0.2419 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