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
   -3.8920    1.3528    0.3385 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1497   -0.1816   -0.1702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6662   -0.1353   -0.0290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8762    0.2973   -1.0674 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5175    0.3295   -0.9040 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1445   -0.0502    0.2453 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3279   -0.4894    1.2967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0396   -0.5210    1.1364 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5907   -0.0116    0.4007 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4513    0.3793   -0.5110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5146   -0.9580    0.5358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4410   -0.4118   -1.2164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3103    0.6160   -2.0151 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1134    0.6785   -1.7488 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8014   -0.7889    2.1995 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6994   -0.8597    1.9418 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0408   -0.3334    1.3603 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0708    0.7050   -1.4686 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5309    0.3823   -0.3246 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