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
-2.1048 -1.3811 -0.0455 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2101 -0.4877 0.5496 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0509 -0.0574 -0.4696 P 0 0 0 0 0 5 0 0 0 0 0 0
0.1080 -0.9955 -1.6427 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6180 -0.1904 0.4018 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2968 -1.3278 0.4248 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2105 1.5016 -1.0453 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1591 2.4526 -0.0258 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3323 -2.2451 0.6408 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7024 -1.8088 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1026 -0.8944 -0.2254 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0172 0.6744 0.9187 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2322 -1.3580 0.9611 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9275 -2.2129 -0.0813 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7689 2.4197 0.5578 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0422 2.4565 0.6187 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1554 3.4544 -0.5466 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