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
    1.7284    4.3885    0.5527 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6539    3.9665    1.1968 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2711    3.1396    0.6355 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1636    1.5707   -0.0011 P   0  0  0  0  0  5  0  0  0  0  0  0
    1.1708    1.8601   -1.1007 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0950    0.8338    1.2644 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7912   -0.3377    0.9401 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5601   -0.9755    1.9179 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2653   -2.1277    1.6583 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2196   -2.6819    0.3932 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4617   -2.0623   -0.5897 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7592   -0.9054   -0.3120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1249    0.7402   -0.3338 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1147   -0.0057   -0.6443 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4635    0.3124   -0.3872 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4890   -0.5145   -0.7364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2539   -1.7165   -1.3658 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9538   -2.0758   -1.6405 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9192   -1.2428   -1.2888 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4641    5.0352    0.9728 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8612    4.0549   -0.4569 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5303    4.3115    2.2184 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5675   -0.5057    2.8983 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8581   -2.5982    2.4533 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7642   -3.5921    0.1516 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4379   -2.5186   -1.5911 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1753   -0.4470   -1.1064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6162    1.2583    0.1062 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5350   -0.2433   -0.5243 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0846   -2.3367   -1.6233 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8078   -3.0281   -2.1364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8934   -1.5561   -1.5206 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