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
    0.4876    4.3382    0.7631 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1346    3.1957    0.5700 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5523    2.1936   -0.0964 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0353    0.5931   -0.2398 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.3228   -0.0207    1.1039 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1247   -0.3179   -1.0874 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3476   -0.6444   -0.5128 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2466   -1.3937   -1.2698 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4865   -1.7615   -0.7724 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8253   -1.3679    0.5076 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9228   -0.6265    1.2426 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6821   -0.2530    0.7575 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4827    0.5704   -1.1748 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5572   -0.1953   -0.7794 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5012    0.3563    0.0457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6153   -0.3597    0.4860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7188   -1.6637    0.0439 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8042   -2.2481   -0.7750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7062   -1.4961   -1.1908 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0179    5.1393    1.2783 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4971    4.5331    0.4317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1432    3.0778    0.9310 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9495   -1.6897   -2.2786 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1488   -2.3472   -1.4083 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8043   -1.6586    0.8995 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1721   -0.3109    2.2449 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9801    0.3307    1.3454 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4291    1.3733    0.3960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3613    0.0905    1.1436 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5692   -2.2431    0.3672 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8614   -3.2652   -1.1351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9671   -1.9289   -1.8373 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