Monomers
Diethyl vinyl phosphate
Identifiers
IUPAC name
ethenyl diethyl phosphate
InchI
InChI=1S/C6H13O4P/c1-4-8-11(7,9-5-2)10-6-3/h4H,1,5-6H2,2-3H3
InchI Key
ULUJSLFWDQSXRS-UHFFFAOYSA-N
SMILES
CCOP(=O)(OC=C)OCC
Canonical SMILES
CCOP(=O)(OCC)OC=C
Isomeric SMILES
CCOP(=O)(OCC)OC=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C6H13O4P
Heavy Atom Count
11
Molecular Weight
180.14
Exact Molecular Weight
180.0551
Valence Electrons
66
Radical Electrons
0
tPSA
44.76
MolLogP
2.3276
H Bond Acceptors
4
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
24 23 0 0 0 0 0 0 0 0999 V2000
3.4978 -0.1343 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2289 -0.9754 0.0526 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3179 -0.2425 0.8823 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0409 0.2893 -0.0954 P 0 0 0 0 0 5 0 0 0 0 0 0
0.7747 1.0974 -1.2497 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8783 1.3737 0.7914 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5906 2.6872 1.1108 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3734 3.5767 0.6138 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9146 -0.8232 -0.8318 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7025 -1.6013 -0.0211 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6416 -2.3946 -0.9644 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3218 0.8796 0.3908 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6494 0.0180 -1.1492 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3522 -0.5888 0.4207 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4465 -1.8821 0.7103 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7121 -1.2897 -0.8335 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2365 2.9844 1.7328 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1755 4.6673 0.8573 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2184 3.3099 -0.0248 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0310 -2.2650 0.5225 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2902 -1.0208 0.6811 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6923 -1.9748 -0.8651 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3844 -2.2291 -2.0215 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6860 -3.4619 -0.6759 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 1 0
7 8 2 3
4 9 1 0
9 10 1 0
10 11 1 0
1 12 1 0
1 13 1 0
1 14 1 0
2 15 1 0
2 16 1 0
7 17 1 0
8 18 1 0
8 19 1 0
10 20 1 0
10 21 1 0
11 22 1 0
11 23 1 0
11 24 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers