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
-1.9979 -1.2799 -0.2172 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1845 -0.8337 -1.2237 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2571 -0.1656 -0.7110 P 0 0 0 0 0 5 0 0 0 0 0 0
1.3307 -0.5421 -1.7031 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1519 1.6313 -0.6049 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7174 2.2130 0.2094 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7187 -0.7147 0.8179 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1083 -0.7851 0.8578 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0486 -1.3718 -0.6156 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7507 -2.3199 0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0192 -0.6510 0.6846 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7965 2.2342 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7702 3.2923 0.2635 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4014 1.6628 0.8456 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5282 0.0304 0.2079 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5283 -0.6684 1.8637 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4702 -1.7317 0.3962 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