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
    0.2418    3.9095    0.2403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8830    3.3894    0.6949 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1399    2.0573    0.6330 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0760    0.8425    0.1593 P   0  0  0  0  0  5  0  0  0  0  0  0
    0.4534    1.1995   -1.2276 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3032    0.7376    1.1810 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4015    0.0481    0.6860 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3623    0.7289   -0.0258 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4627    0.0719   -0.5290 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6556   -1.2882   -0.3470 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6971   -1.9794    0.3656 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5848   -1.3062    0.8724 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8017   -0.6639    0.0713 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0915   -0.9544   -0.2563 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0655   -0.0455   -0.5848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3582   -0.4581   -0.9045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7020   -1.7785   -0.9025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7382   -2.7099   -0.5752 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4716   -2.2937   -0.2628 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0167    3.2828   -0.2075 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4675    4.9661    0.2791 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6104    4.0582    1.1262 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2674    1.8093   -0.2046 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2075    0.6405   -1.0897 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5281   -1.7700   -0.7545 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8353   -3.0473    0.5164 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8405   -1.8792    1.4337 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8175    0.9850   -0.5919 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0691    0.2983   -1.1510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7148   -2.0444   -1.1571 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0513   -3.7490   -0.5851 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7347   -3.0572   -0.0088 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