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
   -4.0150    0.0489    0.7572 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.6438   -0.9121    1.3464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3972   -0.5541    0.6052 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0268   -1.2042   -0.5505 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1306   -0.8489   -1.2104 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9619    0.1692   -0.7409 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5736    0.7998    0.4078 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5966    0.4456    1.0812 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1705    0.4960   -1.4846 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9869    1.4360   -1.0976 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8234   -2.0085    1.2190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5218   -0.6968    2.4120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6655   -2.0065   -0.9362 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4295   -1.3590   -2.1252 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1951    1.6120    0.8219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8697    0.9656    1.9836 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4181   -0.0505   -2.3955 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8250    2.0222   -0.2189 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8686    1.6452   -1.6763 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