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
2.4203 0.0278 0.4922 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1303 0.5737 0.6113 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1380 -0.2711 -0.4580 P 0 0 0 0 0 5 0 0 0 0 0 0
1.0029 -0.8245 -1.5944 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6366 -1.6705 0.3203 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8765 -1.5512 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0398 0.6831 -1.1526 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0863 1.9697 -0.6939 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0460 0.2342 1.3604 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3161 -1.0882 0.3563 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8531 0.4073 -0.4484 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0867 -2.5824 0.4308 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4391 -0.6501 0.6429 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3493 -2.4006 1.2183 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3880 2.6223 -1.5652 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8779 2.1432 0.0758 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1267 2.3773 -0.3408 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