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
   -2.6791    0.7345    0.4930 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8641   -0.2887    0.5332 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4292   -0.1898    0.2879 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1939    1.0083   -0.0107 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5546    1.0551   -0.2355 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3430    2.5873   -0.6160 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.3091   -0.0850   -0.1664 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7066   -1.2935    0.1306 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3527   -1.3242    0.3517 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4048   -2.8776    0.7308 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.7294    0.5749    0.6871 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3649    1.7425    0.2753 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2640   -1.2735    0.7608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3726    1.9066   -0.0696 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3745   -0.0647   -0.3397 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2735   -2.2121    0.1928 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