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
   -3.7458    1.2903   -1.2523 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1380    0.3453    0.1134 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6695    0.1166    0.0363 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1402   -0.9831   -0.6026 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2117   -1.2102   -0.6835 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1389   -0.3266   -0.1146 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5987    0.7678    0.5208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7699    0.9946    0.6008 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5658   -0.5968   -0.2183 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4843    0.1873    0.2906 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6916   -0.6340    0.1337 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4163    0.8728    1.0330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8622   -1.6775   -1.0494 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6130   -2.0835   -1.1917 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2886    1.4820    0.9782 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1574    1.8646    1.1076 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9019   -1.4835   -0.7372 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5482   -0.0168    0.2117 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2396    1.0908    0.8234 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