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
   -2.7127    0.5618    0.6751 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7045   -0.2336    0.8231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3772   -0.0993    0.2400 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3867   -1.2749    0.0693 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6463   -1.2548   -0.4514 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5422   -2.7785   -0.6340 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.2379   -0.0709   -0.8394 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5276    1.0722   -0.6861 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2280    1.0529   -0.1485 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6194    2.5745    0.0579 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.6994    1.4516    0.0819 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6676    0.3189    1.1933 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8770   -1.1145    1.4696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0719   -2.2121    0.3725 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2355   -0.0409   -1.2543 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9257    2.0476   -0.9689 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