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
    2.5740   -1.0414    0.1817 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8911    0.0333   -0.1353 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4463    0.1021   -0.0637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3430   -0.9394    0.3387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7328   -0.8418    0.3970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3634    0.3118    0.0501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5847    1.3806   -0.3607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2046    1.2703   -0.4141 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7855    2.6304   -0.9369 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.0952   -1.9418    0.5162 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6509   -1.0839    0.1254 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4932    0.8856   -0.4616 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1166   -1.8692    0.6214 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3219   -1.6785    0.7173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4385    0.4542    0.0727 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0639    2.3278   -0.6481 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