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
    3.5702   -2.2318   -1.3506 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.1381   -0.6363   -0.7063 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6928   -0.6167   -0.2437 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3792    0.6421    0.2559 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1879    0.7765    0.7934 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.3159    0.1991    2.2048 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3203    0.0641   -0.1963 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7514   -1.1762    0.2886 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7676   -1.8169   -0.5983 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1341   -2.1070   -2.2393 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.5845    2.5256    0.9190 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0292    3.4314    0.1779 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8333   -0.3542    0.1053 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3102    0.0962   -1.5284 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0442   -0.7906   -1.1206 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5968   -1.3730    0.5480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1506   -1.1152    1.3039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8570   -1.8344    0.3072 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9992   -2.8164   -0.1737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7329   -1.2686   -0.6265 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3548    2.8185    1.6327 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7919    3.1177   -0.5253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2297    4.4661    0.2761 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