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
0.3416 2.3913 -0.3437 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0717 1.4210 0.5537 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2219 -0.1021 -0.1401 P 0 0 0 0 0 5 0 0 0 0 0 0
0.2743 -0.1497 -1.5582 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9300 -0.6396 -0.0674 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2450 -1.9160 -0.0916 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6963 -1.1776 0.8088 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0456 -0.8533 0.6902 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6210 3.2851 0.2553 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2355 2.1118 -0.9248 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5247 2.6826 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7029 0.1124 -0.0027 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5082 -2.6863 -0.1549 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2832 -2.2128 -0.0465 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3323 -0.0293 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2909 -0.5054 -0.3521 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6502 -1.7319 0.9817 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