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
-0.8914 1.8680 -0.6302 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2941 1.1722 -0.6184 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1378 -0.4085 -0.0711 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.3080 -1.2591 -1.2382 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9472 -0.5567 1.3219 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8844 -1.4755 1.3418 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7126 -0.9401 0.3389 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5635 -0.3706 -0.6112 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6545 2.9490 -0.4204 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6344 1.5135 0.1024 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3526 1.8779 -1.6492 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8324 0.1098 2.1486 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0105 -2.1613 0.5031 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5554 -1.5771 2.1885 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7713 0.6899 -0.4156 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4965 -0.9807 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0951 -0.4509 -1.6268 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