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
-1.0385 1.8894 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5553 0.7934 0.6755 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1633 -0.3492 -0.3259 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.4740 -0.3130 -1.6834 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9164 -0.1192 -0.4856 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6872 0.5007 0.3851 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1934 -1.8842 0.3410 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5803 -1.9995 0.3847 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4121 1.6114 -1.0412 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8837 2.3638 0.5198 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2250 2.6394 -0.1136 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3773 -0.5246 -1.3726 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7479 0.5975 0.2115 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2929 0.9301 1.2936 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9171 -1.9554 1.4507 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8184 -3.0010 -0.0633 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0873 -1.1796 -0.1455 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