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
   -2.5042   -1.1814   -0.2180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9280   -0.0051   -0.1121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4926    0.1328   -0.0204 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3667   -0.9590   -0.0378 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7491   -0.7621    0.0545 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7989   -2.1493    0.0300 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.3136    0.4898    0.1643 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4538    1.5647    0.1806 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0911    1.3869    0.0907 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9869    2.7655    0.1130 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.5853   -1.2157   -0.2828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9946   -2.1223   -0.2463 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5365    0.8911   -0.0922 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0062   -1.9701   -0.1216 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3870    0.5884    0.2326 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8742    2.5458    0.2654 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