Monomers

2,6-Dichlorostyrene

Identifiers

IUPAC name
1,3-dichloro-2-ethenylbenzene
InchI
InChI=1S/C8H6Cl2/c1-2-6-7(9)4-3-5-8(6)10/h2-5H,1H2
InchI Key
YJCVRMIJBXTMNR-UHFFFAOYSA-N
SMILES
C=Cc1c(Cl)cccc1Cl
Canonical SMILES
C=CC1=C(C=CC=C1Cl)Cl
Isomeric SMILES
C=CC1=C(C=CC=C1Cl)Cl
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H6Cl2
Heavy Atom Count
10
Molecular Weight
173.042
Exact Molecular Weight
171.9847
Valence Electrons
52
Radical Electrons
0
tPSA
0.0
MolLogP
3.6364
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 16 16  0  0  0  0  0  0  0  0999 V2000
   -2.6574   -0.6079    0.5134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7912    0.2566    0.1044 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3742    0.1174   -0.0657 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3942    1.2899    0.0307 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4170    2.8171    0.3727 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.7545    1.2630   -0.1351 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3653    0.0579   -0.4005 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6360   -1.0943   -0.4988 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2472   -1.0621   -0.3293 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6662   -2.5380   -0.4934 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.7106   -0.3268    0.5806 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4155   -1.5915    0.8126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2260    1.2582   -0.1577 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3230    2.2004   -0.0526 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4496    0.0226   -0.5345 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0885   -2.0627   -0.7075 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  4  5  1  0
  4  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
  9  3  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  6 14  1  0
  7 15  1  0
  8 16  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers