Monomers

1-(Chloromethyl)-4-vinylbenzene

Identifiers

IUPAC name
1-(chloromethyl)-4-ethenylbenzene
InchI
InChI=1S/C9H9Cl/c1-2-8-3-5-9(7-10)6-4-8/h2-6H,1,7H2
InchI Key
ZRZHXNCATOYMJH-UHFFFAOYSA-N
SMILES
ClCc1ccc(cc1)C=C
Canonical SMILES
C=CC1=CC=C(C=C1)CCl
Isomeric SMILES
C=CC1=CC=C(C=C1)CCl
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C9H9Cl
Heavy Atom Count
10
Molecular Weight
152.624
Exact Molecular Weight
152.0393
Valence Electrons
52
Radical Electrons
0
tPSA
0.0
MolLogP
3.0684
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

 19 19  0  0  0  0  0  0  0  0999 V2000
   -3.6631    0.7802    1.8197 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.0990    0.4361    0.1468 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6483    0.1574    0.1596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2022   -1.1271    0.3281 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1496   -1.3715    0.3379 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0991   -0.3529    0.1815 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6270    0.9301    0.0137 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7344    1.1623    0.0057 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5152   -0.6820    0.2019 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4589    0.2054    0.0635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6013   -0.4721   -0.2471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3126    1.3281   -0.5100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8800   -1.9733    0.4561 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5095   -2.3987    0.4725 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3230    1.7760   -0.1145 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0637    2.1839   -0.1287 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7927   -1.7250    0.3403 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2370    1.2417   -0.0750 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4927   -0.0987    0.0871 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  9 10  2  3
  8  3  1  0
  2 11  1  0
  2 12  1  0
  4 13  1  0
  5 14  1  0
  7 15  1  0
  8 16  1  0
  9 17  1  0
 10 18  1  0
 10 19  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers