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
1.4299 -2.0432 0.0938 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0933 -1.0715 1.0349 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0876 -0.0168 0.4615 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.6003 0.7744 1.6578 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6724 1.1122 -0.6732 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1792 2.2325 -0.2238 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3307 -0.8713 -0.2873 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3940 -0.0479 -0.5925 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6896 -2.8517 0.0586 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5382 -1.6069 -0.9347 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4150 -2.4477 0.3878 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7107 0.8710 -1.7093 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1661 2.5251 0.8201 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6467 2.9313 -0.9079 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9323 -0.5125 -1.4685 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0963 0.0590 0.2822 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0998 0.9640 -0.9243 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