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
   -3.9074   -0.6972   -0.8985 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1085    0.2239    0.3872 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6361    0.0621    0.3543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8750    0.9276   -0.3878 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5197    0.7814   -0.4244 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1468   -0.2240    0.2772 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3612   -1.0981    1.0284 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0032   -0.9404    1.0530 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5813   -0.4150    0.2705 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3820    0.3601   -0.4064 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5381   -0.1086    1.3554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3266    1.3248    0.3015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3528    1.7157   -0.9392 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0702    1.4914   -1.0253 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8599   -1.9018    1.5895 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6312   -1.6174    1.6370 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0026   -1.2320    0.8496 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0137    1.1725   -0.9876 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4413    0.1750   -0.3776 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