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
-0.7937 2.3788 -0.7183 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3483 1.1384 -1.1689 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3947 -0.0387 0.0317 P 0 0 0 0 0 5 0 0 0 0 0 0
-1.1048 0.5410 1.2582 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2541 -0.4431 0.5245 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1694 0.5035 0.4291 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2993 -1.3217 -0.5044 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9092 -2.5549 -0.0422 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5919 2.8087 -1.3605 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0777 3.0807 -0.7461 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1868 2.3205 0.3235 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5226 -1.4063 0.8874 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1830 0.2773 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9578 1.4940 0.0702 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8249 -2.5492 1.0545 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7212 -3.2782 -0.2899 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0104 -2.9509 -0.4738 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