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
2.2610 0.8844 0.3477 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1503 1.2031 -0.3888 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1804 0.2166 -0.0701 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.2146 -0.2331 1.3677 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6405 1.2099 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6750 1.2127 0.4543 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1989 -1.0544 -1.1530 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2814 -2.2373 -0.6275 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3518 -0.1811 0.5856 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3121 1.4409 1.3201 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1570 1.1431 -0.2776 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6567 1.8340 -1.2351 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5478 1.8068 0.2852 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6635 0.5887 1.3409 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3070 -2.1773 -0.2424 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3630 -2.6883 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3199 -2.9687 -1.4829 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