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
-0.6962 2.5066 -0.1845 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0010 1.4987 -0.8233 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0430 0.1295 0.1761 P 0 0 0 0 0 5 0 0 0 0 0 0
0.2061 0.6099 1.6037 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3241 -0.9093 -0.2702 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5449 -0.4037 -0.1728 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5235 -0.5784 0.0759 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5634 -1.9421 0.1816 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3175 2.6106 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5759 3.4658 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7875 2.2883 -0.0854 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2260 -1.9238 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7374 0.6200 0.1692 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3969 -0.9834 -0.4275 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2444 -2.3243 -0.6255 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5975 -2.4429 0.1805 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0855 -2.2214 1.1418 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