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
    2.5788    1.0107   -0.0460 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7334    0.2638   -0.6731 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3704    0.0328   -0.2636 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3950    0.8889    0.4826 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2266    2.4587    0.9576 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.7026    0.5580    0.8620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2966   -0.6299    0.5149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5233   -1.4872   -0.2367 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2445   -1.1877   -0.6192 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7030   -2.3086   -1.5757 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.6201    1.1489   -0.4185 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4183    1.5499    0.8678 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0988   -0.2321   -1.5988 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2911    1.2653    1.4614 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3034   -0.8879    0.8057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9929   -2.4439   -0.5206 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