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
   -3.8326    1.3145    0.4310 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.0967   -0.0023   -0.5123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6431   -0.0299   -0.2593 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1672   -0.8061    0.7832 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1756   -0.8806    1.0784 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1116   -0.1718    0.3325 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6358    0.6023   -0.7073 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7320    0.6805   -1.0108 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5198   -0.2625    0.6577 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4415    0.3888   -0.0183 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5273   -0.9800   -0.2556 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2487    0.1767   -1.6171 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8378   -1.3854    1.4070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5093   -1.5107    1.9167 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2873    1.1756   -1.3265 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0699    1.2970   -1.8328 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7884   -0.9019    1.4978 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2177    1.0254   -0.8482 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4685    0.2704    0.2841 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