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
1.3013 1.7499 -0.0201 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9786 0.4721 0.3698 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0314 -0.3225 -0.7323 P 0 0 0 0 0 5 0 0 0 0 0 0
0.1952 0.1854 -2.1370 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7485 -0.1781 -0.2747 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2348 0.9969 0.0815 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3745 -1.9735 -0.6587 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9040 -2.2522 0.6002 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6379 2.1754 -0.7937 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3799 1.8032 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2822 2.3838 0.9142 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4142 -1.0285 -0.2785 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2920 1.1059 0.3673 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5718 1.8613 0.0888 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7780 -2.9364 0.4897 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1810 -2.7305 1.2757 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2802 -1.3122 1.0589 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