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
-0.3279 2.3639 -0.1745 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4747 1.1578 0.5172 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0107 -0.1435 -0.4029 P 0 0 0 0 0 5 0 0 0 0 0 0
0.4659 0.3231 -1.7679 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4046 -0.9467 0.4145 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6146 -0.8494 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1835 -1.2990 -0.6255 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1127 -1.3366 0.4055 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0996 3.1064 0.1047 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6667 2.7960 0.0833 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3388 2.1529 -1.2747 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2398 -1.5077 1.3136 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4404 -1.3356 0.4181 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8297 -0.2925 -0.9893 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8638 -2.1472 1.1396 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0812 -1.6432 -0.0435 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1903 -0.3988 0.9639 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