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
-1.7179 -1.3683 -1.0197 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5001 -1.5274 -0.3462 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1627 0.0128 -0.1446 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.2952 0.8604 -1.3339 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9447 -0.0290 -0.1234 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6393 -1.1155 -0.4171 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4631 0.6419 1.2930 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9414 1.9349 1.0242 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3797 -2.2120 -0.8175 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5082 -1.3603 -2.1142 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1561 -0.3756 -0.7876 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4621 0.8744 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7161 -1.0663 -0.3833 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1397 -2.0636 -0.6938 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9954 1.9664 1.3235 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8097 2.2031 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2978 2.6240 1.5894 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