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
2.8075 0.2257 0.0523 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6902 -0.0399 0.8336 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2498 0.1937 -0.0124 P 0 0 0 0 0 5 0 0 0 0 0 0
0.5558 0.8664 -1.3039 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4411 -1.4206 -0.3499 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3532 -1.9865 0.4078 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7728 1.1169 0.9559 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8950 1.5614 0.2725 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6947 0.0280 0.6928 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8755 -0.4887 -0.7939 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8639 1.2824 -0.2526 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0759 -1.9382 -1.2252 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7609 -1.5261 1.2947 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7230 -2.9649 0.1393 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7199 2.4961 -0.2971 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3268 0.7947 -0.3907 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6688 1.7996 1.0318 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