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
    2.7617    0.0110   -0.2751 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7453    0.8148   -0.2252 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3916    0.3096   -0.0586 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0673   -1.0208    0.0581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2519   -1.4374    0.2157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5551   -3.1698    0.3557 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.2916   -0.5437    0.2622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9837    0.8013    0.1463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6826    1.2087   -0.0089 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3151    2.9256   -0.1544 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.6890   -1.0534   -0.2003 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7665    0.4019   -0.3998 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9004    1.8795   -0.3082 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8719   -1.7714    0.0258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3023   -0.8547    0.3824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8114    1.4988    0.1842 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