Monomers

Diphenyl vinyl phosphate

Identifiers

IUPAC name
ethenyl diphenyl phosphate
InchI
InChI=1S/C14H13O4P/c1-2-16-19(15,17-13-9-5-3-6-10-13)18-14-11-7-4-8-12-14/h2-12H,1H2
InchI Key
RJYNTEFVOZNXEM-UHFFFAOYSA-N
SMILES
C=COP(=O)(Oc1ccccc1)Oc1ccccc1
Canonical SMILES
C=COP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2
Isomeric SMILES
C=COP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C14H13O4P
Heavy Atom Count
19
Molecular Weight
276.228
Exact Molecular Weight
276.0551
Valence Electrons
98
Radical Electrons
0
tPSA
44.76
MolLogP
4.4126
H Bond Acceptors
4
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
2
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
2

MOL File


     RDKit          3D

 32 33  0  0  0  0  0  0  0  0999 V2000
    0.0050    4.3824   -0.1841 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3637    3.1647   -0.5440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4748    2.0681   -0.4192 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1338    0.4684   -0.3465 P   0  0  0  0  0  5  0  0  0  0  0  0
    0.4681    0.0042   -1.7492 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9790   -0.5336    0.4318 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3354   -0.5595    0.1688 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9304    0.2487   -0.7771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3045    0.1754   -0.9958 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1129   -0.6917   -0.2893 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5095   -1.4970    0.6555 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1526   -1.4217    0.8684 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5579    0.5281    0.6331 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5804   -0.3769    0.5130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5522   -1.5225    1.2643 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5607   -2.4463    1.1658 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6165   -2.2331    0.3087 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6425   -1.0806   -0.4456 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6279   -0.1538   -0.3449 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6324    5.2439   -0.2700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9900    4.5044    0.2226 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3517    3.0332   -0.9497 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3008    0.9310   -1.3343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7496    0.8188   -1.7426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1777   -0.7284   -0.4791 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1661   -2.1758    1.2033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7007   -2.0563    1.6078 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7364   -1.6880    1.9272 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4843   -3.3321    1.7840 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4207   -2.9556    0.2211 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4692   -0.8768   -1.1404 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6806    0.7585   -0.9638 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
  4 13  1  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 12  7  1  0
 19 14  1  0
  1 20  1  0
  1 21  1  0
  2 22  1  0
  8 23  1  0
  9 24  1  0
 10 25  1  0
 11 26  1  0
 12 27  1  0
 15 28  1  0
 16 29  1  0
 17 30  1  0
 18 31  1  0
 19 32  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers