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
-2.1568 -1.3455 -0.1675 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0442 -1.3282 0.6556 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1504 -0.2640 0.1266 P 0 0 0 0 0 5 0 0 0 0 0 0
0.2793 -0.2182 -1.3635 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1910 1.3448 0.8043 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7038 2.3464 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6200 -0.7924 0.8196 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6053 -0.6773 -0.1352 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7792 -2.2148 0.1565 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8471 -1.5864 -1.2132 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7388 -0.4124 -0.1302 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0344 1.5142 1.8459 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9131 3.3240 0.5172 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9350 2.1922 -0.9325 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4493 -1.4536 -0.8976 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6158 -0.7878 0.3487 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5546 0.3588 -0.5467 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