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
   -1.8532   -3.5167   -1.8702 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.7013   -2.6022   -0.6020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7611   -1.5742    0.0156 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3584   -0.7329   -0.9869 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3052    0.4748   -0.4706 P   0  0  0  0  0  5  0  0  0  0  0  0
   -0.0573    1.3824   -1.6708 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1743   -0.1161    0.0244 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2185    0.7243   -0.3571 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5491    0.1626    0.1058 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5877   -0.0024    1.8763 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.1067    1.4632    0.7700 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7615    2.7123    1.0153 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5683   -2.1059   -1.0778 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0950   -3.2881    0.1709 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3984   -1.0016    0.7466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9689   -2.0411    0.5985 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1250    1.7359    0.1201 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2707    0.7887   -1.4645 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7724   -0.8184   -0.3497 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3765    0.8411   -0.1825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9049    1.0223    1.3422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2704    3.2869    1.7784 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0364    3.2052    0.4679 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