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
   -3.7908    0.9662   -1.0216 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1395    0.1443    0.4401 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6676    0.0253    0.2293 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7765    0.9939    0.6325 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6010    0.8492    0.4181 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1218   -0.2659   -0.2039 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2118   -1.2343   -0.6051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1431   -1.0877   -0.3921 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5506   -0.4491   -0.4431 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4863    0.3934   -0.1085 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6230   -0.8183    0.5974 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3674    0.8444    1.2904 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1449    1.8836    1.1239 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2931    1.6149    0.7382 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6190   -2.1165   -1.0967 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8405   -1.8617   -0.7158 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8574   -1.3640   -0.9415 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2451    1.3081    0.3830 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5074    0.1742   -0.3245 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