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
Resources
cid=

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
   -2.3495   -1.6736   -1.1955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4722   -1.1573   -0.0782 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7065   -0.0619   -0.4856 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2211    0.4169    0.8395 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.5575    0.0890    2.0901 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3565    2.1388    0.7758 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7287    2.9479    1.0400 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9799    2.5840    0.8462 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7561   -0.2152    0.8343 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2401   -0.4746   -0.4471 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6397   -1.0486   -0.4040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7850   -1.5347   -2.1372 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5783   -2.7442   -1.0962 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2984   -1.1183   -1.2697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8374   -2.0169    0.2441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1066   -0.9068    0.7964 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5453    3.9366    1.4277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7989    3.2426    1.0640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2393    1.5967    0.4557 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3240    0.5288   -0.9591 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5465   -1.0741   -1.0608 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1203   -0.7758   -1.3837 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5737   -2.1404   -0.2748 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2053   -0.5386    0.3782 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