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
1.4330 -1.8558 -0.3749 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1053 -1.5141 -0.4221 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1991 0.1068 -0.1246 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.5198 0.3151 1.3343 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1212 1.1751 -0.5742 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1687 2.3989 -0.0854 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5655 0.5438 -1.0547 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5953 -0.3051 -0.6353 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6485 -2.4889 -1.2836 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1031 -1.0000 -0.2857 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5499 -2.5806 0.4832 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8909 0.8411 -1.2438 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4246 2.8048 0.5973 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9766 3.1049 -0.3383 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3532 -0.3498 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9785 0.1354 0.3188 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2102 -1.3317 -0.4585 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