Monomers

2,6-Dichlorostyrene

Identifiers

IUPAC name
1,3-dichloro-2-ethenylbenzene
InchI
InChI=1S/C8H6Cl2/c1-2-6-7(9)4-3-5-8(6)10/h2-5H,1H2
InchI Key
YJCVRMIJBXTMNR-UHFFFAOYSA-N
SMILES
C=Cc1c(Cl)cccc1Cl
Canonical SMILES
C=CC1=C(C=CC=C1Cl)Cl
Isomeric SMILES
C=CC1=C(C=CC=C1Cl)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
   -2.7487    0.1374   -0.6057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7280    0.5827    0.0622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3469    0.1973   -0.0136 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6177    1.0861    0.4162 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1474    2.6811    1.0234 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.9590    0.7555    0.3829 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3584   -0.4743   -0.0825 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4043   -1.3503   -0.5059 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0352   -1.0249   -0.4763 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0707   -2.2760   -1.0268 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.7539   -0.6219   -1.3618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7529    0.5652   -0.4021 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9761    1.3859    0.8124 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7306    1.4369    0.7149 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4210   -0.7621   -0.1197 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7038   -2.3184   -0.8735 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
  4  6  1  0
  6  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
  6 14  1  0
  7 15  1  0
  8 16  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers