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
    0.2273    3.8288    0.3816 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8314    3.5075   -0.3102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8415    2.3585   -1.0594 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0395    0.9855   -0.3767 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.1624    1.0609    1.1480 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6030    1.1187   -0.7526 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5230    0.1277   -0.5106 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1624   -1.0673    0.0670 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0936   -2.0594    0.3072 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4090   -1.8334   -0.0445 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7695   -0.6396   -0.6215 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8398    0.3308   -0.8529 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7147   -0.4660   -0.9207 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0265   -0.8052   -0.6259 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5267   -2.0028   -1.0954 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8302   -2.3467   -0.8062 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6091   -1.4910   -0.0553 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0948   -0.2874    0.4123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7909    0.0658    0.1280 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0958    3.1797    0.3577 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3171    4.7147    0.9968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6941    4.1341   -0.2983 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1407   -1.2620    0.3483 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8008   -2.9987    0.7631 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1144   -2.6217    0.1532 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7996   -0.4765   -0.8911 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1489    1.2665   -1.3103 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9109   -2.6881   -1.6939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2356   -3.2872   -1.1703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6416   -1.7504    0.1809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6881    0.3997    1.0036 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4069    1.0044    0.4989 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