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
-1.0307 1.6593 0.9671 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0119 0.7132 0.9013 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1946 0.1075 -0.6557 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.0390 1.2523 -1.6186 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0384 -1.1368 -1.0411 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7532 -1.7614 -0.1583 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7417 -0.4608 -0.9384 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6238 -0.2277 0.0976 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6482 2.6984 0.9352 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5893 1.5211 1.9224 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7874 1.5124 0.1513 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1597 -1.3499 -2.1134 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6285 -1.5472 0.8892 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4750 -2.4969 -0.4644 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3650 -1.0524 0.1008 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0905 0.7682 -0.0696 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1459 -0.1994 1.0947 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