Monomers

Bis(2-chloroethyl) vinylphosphonate

Identifiers

IUPAC name
1-chloro-2-[2-chloroethoxy(ethenyl)phosphoryl]oxyethane
InchI
InChI=1S/C6H11Cl2O3P/c1-2-12(9,10-5-3-7)11-6-4-8/h2H,1,3-6H2
InchI Key
LHHMNJZNWUJFOC-UHFFFAOYSA-N
SMILES
ClCCOP(=O)(OCCCl)C=C
Canonical SMILES
C=CP(=O)(OCCCl)OCCCl
Isomeric SMILES
C=CP(=O)(OCCCl)OCCCl
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H11Cl2O3P
Heavy Atom Count
12
Molecular Weight
233.031
Exact Molecular Weight
231.9823
Valence Electrons
72
Radical Electrons
0
tPSA
35.53
MolLogP
2.8338
H Bond Acceptors
3
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 23 22  0  0  0  0  0  0  0  0999 V2000
    2.8433   -2.9812    0.1906 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.3002   -1.2819    0.4425 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3092   -0.3470   -0.2224 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0237   -0.5176    0.2880 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0042    0.5458   -0.4945 P   0  0  0  0  0  5  0  0  0  0  0  0
    0.6159    0.9219   -1.8384 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5108   -0.1209   -0.8236 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9463   -0.9900    0.1605 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3129   -1.5045   -0.2820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3938   -0.0736   -0.4397 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.2605    2.0509    0.4283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2127    3.2372   -0.1740 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5034   -1.0369    1.4853 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2705   -1.1371   -0.1097 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6881    0.6880   -0.0317 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3450   -0.5941   -1.3221 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1442   -0.3919    1.0910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2514   -1.8075    0.3770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2535   -1.9454   -1.2877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7814   -2.1486    0.4734 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4580    1.9937    1.4958 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3563    4.1698    0.3169 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0132    3.2708   -1.2455 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
  5 11  1  0
 11 12  2  3
  2 13  1  0
  2 14  1  0
  3 15  1  0
  3 16  1  0
  8 17  1  0
  8 18  1  0
  9 19  1  0
  9 20  1  0
 11 21  1  0
 12 22  1  0
 12 23  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers