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
   -0.8842    4.9663    0.0327 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2627    3.8335    0.2681 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6372    2.7075   -0.4412 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0033    1.1713    0.0305 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.0769    0.9694    1.5094 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6689    1.1891   -0.4399 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5088    0.1230   -0.1501 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8101    0.1947   -0.5460 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6747   -0.8600   -0.2686 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2284   -1.9764    0.4023 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9224   -2.0438    0.7973 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0776   -1.0020    0.5208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7734   -0.0124   -0.8799 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9134   -0.6888   -0.5354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6226   -0.5214    0.6106 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7700   -1.2708    0.8486 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2343   -2.2045   -0.0535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5183   -2.3790   -1.2192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3817   -1.6359   -1.4539 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6746    5.0290   -0.6989 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5923    5.8450    0.5860 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5140    3.7918    0.9934 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2243    1.0251   -1.0678 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7031   -0.8392   -0.5639 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8734   -2.8113    0.6327 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5758   -2.9373    1.3313 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0336   -1.0314    0.8246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2791    0.2054    1.3352 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3238   -1.1261    1.7657 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1385   -2.7925    0.1380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8876   -3.1172   -1.9298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8477   -1.8012   -2.3790 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