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
   -3.6884    0.7155    1.6092 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1509    0.0360    0.0589 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6726   -0.0592    0.0477 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0184   -1.1863    0.4931 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3578   -1.2609    0.4768 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1628   -0.2114    0.0137 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4928    0.9025   -0.4256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9061    0.9867   -0.4126 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6107   -0.3528    0.0227 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4153    0.5806   -0.3925 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6459   -0.9551   -0.0529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4536    0.6452   -0.8071 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6231   -1.9990    0.8510 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8869   -2.1434    0.8249 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0490    1.7467   -0.7950 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3776    1.8867   -0.7699 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0629   -1.2801    0.3923 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0219    1.5054   -0.7630 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4765    0.4430   -0.3718 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