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
    3.5662    0.9927   -1.7302 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.1229    0.2447   -0.1899 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6442    0.0394   -0.0932 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8362    1.0090    0.4361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5549    0.8445    0.5396 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1138   -0.3314    0.0924 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3080   -1.3386   -0.4531 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0357   -1.1251   -0.5292 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5435   -0.5111    0.1941 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3268    0.4008    0.6949 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4628    0.9072    0.6457 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5723   -0.7739   -0.1058 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2768    1.9296    0.7858 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1186    1.6627    0.9713 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8044   -2.2294   -0.7827 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6877   -1.8912   -0.9490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9793   -1.4340   -0.1573 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4240    0.2437    0.7644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0316    1.3605    1.0803 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