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

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
    2.6680    0.6519    0.2417 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8692   -0.1396   -0.4143 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4447   -0.1142   -0.1862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2954   -1.2984   -0.1729 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6480   -1.3567    0.0082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4986   -2.9015    0.0097 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.3113   -0.1597    0.1883 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6490    1.0379    0.1860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2568    1.0372   -0.0057 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5564    2.6025   -0.0536 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.3053    1.3456    0.9720 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7529    0.6043    0.0367 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3241   -0.8235   -1.1446 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2812   -2.2012   -0.3192 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3852   -0.2449    0.3298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1576    1.9604    0.3244 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