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
   -2.8192   -0.0877   -0.1317 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7339   -0.7693    0.0861 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3847   -0.2686    0.0505 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6600   -1.1562   -0.2852 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9603   -0.7326   -0.3111 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2256   -1.8955   -0.7402 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.2948    0.5750   -0.0104 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3240    1.4591    0.3174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0040    1.0060    0.3392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2306    2.1886    0.8178 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.8683    0.9621   -0.3751 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8166   -0.5919   -0.0726 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8653   -1.8450    0.3237 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3597   -2.1761   -0.5156 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3518    0.8416   -0.0518 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5466    2.4905    0.5589 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