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
2.1674 -1.1529 0.3735 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8045 -1.3832 0.4439 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1084 -0.0660 -0.0673 P 0 0 0 0 0 5 0 0 0 0 0 0
0.2688 0.3183 -1.4807 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8364 -0.5042 0.0193 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2637 -1.7450 0.1004 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1214 1.2948 0.9041 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1410 2.4714 0.1623 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4250 -0.1178 0.0802 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6441 -1.8843 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5930 -1.3838 1.3748 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5621 0.2949 0.0039 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3150 -1.9908 0.1519 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5448 -2.5495 0.1163 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8566 2.9388 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5023 2.2519 -0.8501 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8194 3.2073 0.6612 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