Monomers

2,5-Dichlorostyrene

Identifiers

IUPAC name
1,4-dichloro-2-ethenylbenzene
InchI
InChI=1S/C8H6Cl2/c1-2-6-5-7(9)3-4-8(6)10/h2-5H,1H2
InchI Key
IZMZREOTRMMCCB-UHFFFAOYSA-N
SMILES
C=Cc1cc(Cl)ccc1Cl
Canonical SMILES
C=CC1=C(C=CC(=C1)Cl)Cl
Isomeric SMILES
C=CC1=C(C=CC(=C1)Cl)Cl
Resources
cid=

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
   -2.8345    0.0358    0.0230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7742   -0.5951   -0.4032 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4001   -0.1736   -0.2546 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5847   -1.1862   -0.2246 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9161   -0.9139   -0.1061 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0640   -2.2640   -0.0791 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.3434    0.3924   -0.0104 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4049    1.3848   -0.0383 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0356    1.1164   -0.1601 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1179    2.4203   -0.2287 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.8477   -0.3708   -0.1431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8093    0.9501    0.5623 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9292   -1.5593   -0.9425 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2567   -2.2334   -0.3001 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4126    0.5919    0.0845 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6949    2.4046    0.0329 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
  5  6  1  0
  5  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
  4 14  1  0
  7 15  1  0
  8 16  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers