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
   -0.1771    4.3756   -0.8505 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5168    3.2563   -0.9933 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8006    2.3972    0.0324 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2887    1.2126    0.6119 P   0  0  0  0  0  5  0  0  0  0  0  0
   -1.2252    1.8199    1.6554 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6028   -0.0958    1.2643 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8561   -0.4241    0.7674 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0119    0.1263    1.2786 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2723   -0.1771    0.8093 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3869   -1.0793   -0.2273 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2613   -1.6598   -0.7757 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0075   -1.3351   -0.2828 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2705    0.5945   -0.6455 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1790   -0.4100   -0.3085 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0077   -0.9530   -1.2962 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9083   -1.9428   -0.9830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0254   -2.4297    0.3007 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2091   -1.8946    1.2726 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2906   -0.8921    0.9775 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3908    5.0413   -1.6737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5504    4.6442    0.1270 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8807    3.0074   -1.9807 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9255    0.8362    2.0938 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1696    0.2850    1.2457 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3855   -1.3264   -0.6067 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3909   -2.3684   -1.5936 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1377   -1.7900   -0.7138 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8940   -0.5476   -2.3088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5484   -2.3545   -1.7724 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7386   -3.2068    0.5251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2513   -2.2345    2.3053 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6511   -0.4747    1.7452 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