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
2.3908 1.3290 -0.1257 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0535 1.4686 0.1504 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1282 0.1988 -0.5202 P 0 0 0 0 0 5 0 0 0 0 0 0
0.8366 -0.3330 -1.7610 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0474 -1.1361 0.6648 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4043 -2.3329 0.3312 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3905 0.7236 -0.9971 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3339 0.6755 0.0164 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0355 1.3935 0.7848 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6893 2.1586 -0.7975 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6581 0.3918 -0.6476 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3701 -0.9856 1.6853 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4444 -3.1262 1.0646 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7408 -2.5420 -0.6753 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8022 -0.3141 0.1252 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1455 1.3960 -0.2775 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9481 1.0345 0.9792 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