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
    1.1957    3.7821    0.0848 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1162    3.0351    0.3099 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0858    1.7122   -0.1081 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1163    0.4957    1.0816 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.9616    1.0779    2.1914 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3966    0.0374    1.7240 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4009   -0.4372    0.8889 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2902    0.4458    0.3326 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2750   -0.0536   -0.4911 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3541   -1.4052   -0.7416 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4479   -2.2665   -0.1693 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4447   -1.7911    0.6651 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9346   -0.8043    0.3963 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2535   -0.8452    0.0480 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7913   -1.9879   -0.5080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1338   -2.0482   -0.8694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9633   -0.9629   -0.6798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4373    0.1852   -0.1247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0972    0.2284    0.2297 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0683    3.3977   -0.4193 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2435    4.8142    0.4005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7157    3.4957    0.8212 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2264    1.5143    0.5316 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9702    0.6505   -0.9240 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1216   -1.8226   -1.3874 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4700   -3.3497   -0.3385 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7285   -2.4584    1.1192 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1191   -2.8305   -0.6481 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5221   -2.9600   -1.3028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0001   -1.0411   -0.9705 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0674    1.0592    0.0375 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7224    1.1330    0.6569 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