Monomers
Dimethyl vinylphosphonate
Identifiers
IUPAC name
1-dimethoxyphosphorylethene
InchI
InChI=1S/C4H9O3P/c1-4-8(5,6-2)7-3/h4H,1H2,2-3H3
InchI Key
CQCXMYUCNSJSKG-UHFFFAOYSA-N
SMILES
COP(=O)(C=C)OC
Canonical SMILES
COP(=O)(C=C)OC
Isomeric SMILES
COP(=O)(C=C)OC
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H9O3P
Heavy Atom Count
8
Molecular Weight
136.087
Exact Molecular Weight
136.0289
Valence Electrons
48
Radical Electrons
0
tPSA
35.53
MolLogP
1.6158
H Bond Acceptors
3
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
17 16 0 0 0 0 0 0 0 0999 V2000
-1.4864 2.0180 -0.4402 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6244 1.3457 -1.2968 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1666 0.0637 -0.4931 P 0 0 0 0 0 5 0 0 0 0 0 0
1.0382 -0.6191 -1.5242 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0676 -1.1366 0.0224 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8525 -2.4396 -0.0618 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0560 0.6314 0.8127 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3528 0.1577 0.8287 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2083 3.0950 -0.3999 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5072 1.9749 -0.8758 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5307 1.5587 0.5732 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0058 -0.7931 0.4095 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5964 -3.1557 0.2488 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0816 -2.8584 -0.4471 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7942 0.4589 1.8139 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4231 -0.9474 0.8001 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9667 0.6460 0.0294 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
3 5 1 0
5 6 2 3
3 7 1 0
7 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
5 12 1 0
6 13 1 0
6 14 1 0
8 15 1 0
8 16 1 0
8 17 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers