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
-1.8642 -1.3722 -0.0918 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5038 -1.5464 -0.0179 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2396 -0.0196 0.0400 P 0 0 0 0 0 5 0 0 0 0 0 0
0.5378 0.2906 1.4970 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7327 1.2434 -0.7022 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7301 2.4700 -0.2024 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7166 -0.2006 -0.8076 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5723 -0.8651 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0831 -0.9625 -1.1203 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1620 -0.6602 0.6948 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3826 -2.3551 0.0449 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3392 1.0310 -1.5698 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3172 3.2872 -0.6284 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1323 2.7183 0.6685 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6886 -0.1704 0.9527 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9770 -1.7403 0.4594 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5152 -1.1483 -0.3855 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