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
2.2926 -1.0340 0.3559 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9323 -1.2712 0.4842 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0134 -0.0246 -0.1101 P 0 0 0 0 0 5 0 0 0 0 0 0
0.5057 0.4878 -1.4497 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6718 -0.6519 -0.3417 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0081 -1.8967 -0.0256 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1275 1.2681 0.9955 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3123 2.4845 0.3284 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5479 -0.4099 -0.5166 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8174 -2.0123 0.2816 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6284 -0.5692 1.3179 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4014 0.0478 -0.7605 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9970 -2.2665 -0.1651 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2292 -2.5306 0.3848 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6659 2.6918 -0.1838 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1046 2.4486 -0.4214 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5249 3.2383 1.1018 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