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
-1.9695 -1.3455 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8825 -0.8937 0.8438 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1236 0.1117 -0.0702 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.5901 0.3430 -1.3996 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6881 -0.6750 -0.4287 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2657 -1.5039 0.4336 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3494 1.5707 0.7617 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2272 2.5838 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9862 -2.4583 0.1975 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9396 -0.9866 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8807 -1.0074 -0.9079 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1764 -0.4690 -1.3746 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2137 -1.9757 0.2073 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8102 -1.7355 1.3889 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2103 2.2262 -0.3725 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4348 2.6997 -0.9008 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3760 3.5152 0.5509 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