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
2.6485 -0.1399 -0.1239 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5118 0.0030 0.6693 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1132 -0.2013 -0.2533 P 0 0 0 0 0 5 0 0 0 0 0 0
0.5286 -0.9595 -1.5114 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0476 -1.2408 0.6114 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0576 -1.8155 -0.0255 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5556 1.2502 -0.7476 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8895 2.1000 0.2711 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9316 -1.2162 -0.2617 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3860 0.2816 -1.1255 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4919 0.3975 0.3303 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9589 -1.4301 1.6776 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7792 -2.4518 0.4703 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1625 -1.6398 -1.0835 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0039 2.0134 0.4206 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7256 3.1558 -0.0816 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4311 1.8933 1.2378 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