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
-2.0066 -1.1631 -0.0542 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6202 -1.3556 0.0181 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0863 0.0788 -0.5407 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.3066 0.2014 -2.0118 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6811 1.4146 0.3795 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0660 2.3803 0.8633 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7316 0.1187 -0.3240 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3316 -1.1179 -0.2197 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4634 -1.0071 0.9393 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5251 -2.0292 -0.5174 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2756 -0.2815 -0.6725 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7566 1.4263 0.5367 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3847 3.2010 1.4258 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1330 2.3878 0.7191 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7245 -1.9576 -0.5649 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2819 -1.0635 -0.8269 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6651 -1.2333 0.8502 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