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
-1.9265 -1.3897 -0.0644 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9142 -0.9466 -0.8797 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2398 -0.0165 -0.0669 P 0 0 0 0 0 5 0 0 0 0 0 0
0.1420 -0.3346 1.3958 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0754 1.7329 -0.3297 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3077 2.2267 -0.2281 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7349 -0.3951 -0.7300 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6737 -0.7817 0.1965 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6071 -1.5270 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2388 -2.3889 -0.4232 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8155 -0.7144 -0.1437 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7405 2.4027 -0.5745 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4932 3.2792 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1470 1.5854 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4983 -1.2959 -0.3805 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1851 0.0850 0.6848 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3111 -1.5217 0.9205 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