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
-1.6486 -1.6498 -0.0078 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4721 -0.5250 -0.8008 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0082 0.2349 -0.5303 P 0 0 0 0 0 5 0 0 0 0 0 0
0.2903 1.1290 -1.7153 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2966 -0.9893 -0.3289 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5579 -0.7615 -0.6208 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0052 1.1958 0.8445 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6550 2.4128 0.6509 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7276 -1.9087 0.0047 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3419 -1.4918 1.0423 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1113 -2.5400 -0.3941 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9958 -1.9463 0.0502 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9330 0.1732 -1.0048 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2789 -1.5510 -0.4722 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0332 2.7507 1.6376 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1012 3.1271 0.2619 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4673 2.3399 -0.1090 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