Monomers

2-Chlorostyrene

Identifiers

IUPAC name
1-chloro-2-ethenylbenzene
InchI
InChI=1S/C8H7Cl/c1-2-7-5-3-4-6-8(7)9/h2-6H,1H2
InchI Key
ISRGONDNXBCDBM-UHFFFAOYSA-N
SMILES
C=Cc1ccccc1Cl
Canonical SMILES
C=CC1=CC=CC=C1Cl
Isomeric SMILES
C=CC1=CC=CC=C1Cl
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H7Cl
Heavy Atom Count
9
Molecular Weight
138.597
Exact Molecular Weight
138.0236
Valence Electrons
46
Radical Electrons
0
tPSA
0.0
MolLogP
2.983
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
    2.7682    0.0554    0.2418 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7738   -0.7214   -0.0976 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3826   -0.2672   -0.0624 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6098   -1.2201    0.2468 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9374   -0.8871    0.2767 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3590    0.3956    0.0054 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3944    1.3243   -0.2964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0327    1.0097   -0.3342 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0859    2.2722   -0.7745 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.6200    1.0504    0.5612 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7765   -0.3957    0.1732 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9694   -1.7653   -0.4271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2475   -2.2233    0.4563 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6786   -1.6613    0.5225 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4133    0.6785    0.0253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7037    2.3552   -0.5169 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  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  8  3  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  4 13  1  0
  5 14  1  0
  6 15  1  0
  7 16  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers