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
3.7017 -0.3034 -0.6203 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2355 -0.7167 -0.3521 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6146 0.3899 0.2595 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0043 0.1557 0.3226 P 0 0 0 0 0 5 0 0 0 0 0 0
-0.5232 0.8412 -1.0395 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7360 1.0914 1.5437 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6366 2.4853 1.2811 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3306 3.1195 0.4785 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4387 -1.4542 0.1931 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8372 -1.5544 0.5397 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6095 -1.8682 -0.7342 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3501 -1.0332 -0.1591 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9247 0.7193 -0.2447 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8774 -0.2029 -1.7278 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8005 -1.0864 -1.2801 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2456 -1.5982 0.3532 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1562 2.9659 1.8808 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1561 2.7968 -0.1839 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0868 4.1912 0.2922 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1779 -0.7495 1.0985 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8821 -2.5438 1.1421 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8963 -0.8371 -1.1352 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5387 -2.3675 -0.4333 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0606 -2.4406 -1.4746 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