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
-0.9159 1.9583 0.6547 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2342 1.6787 -0.1096 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2134 0.0734 -0.6471 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.4079 -0.0002 -2.0149 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9393 -0.4618 -0.7595 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7147 -0.4293 0.3165 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5592 -0.9271 0.4432 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7572 -1.4359 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3395 0.9779 0.9491 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6583 2.5413 0.0882 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5601 2.4777 1.5598 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3271 -0.8076 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3787 -0.0956 1.2855 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7370 -0.7571 0.2055 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7144 -2.5456 -0.1138 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5146 -1.2295 0.8024 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1172 -1.0174 -0.9447 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