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
   -3.9122   -0.1287   -1.3795 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1520    0.2172    0.1685 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6644    0.0491    0.1202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0677   -1.1609    0.4071 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3031   -1.3071    0.3602 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1487   -0.2672    0.0284 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5479    0.9394   -0.2573 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8311    1.0952   -0.2125 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5911   -0.4808   -0.0049 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4626    0.4376   -0.3059 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6148   -0.4259    0.9462 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4082    1.2739    0.4653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7273   -1.9878    0.6701 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7515   -2.2750    0.5915 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1773    1.7693   -0.5193 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2767    2.0640   -0.4443 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9687   -1.4850    0.2408 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1732    1.4524   -0.5600 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5305    0.2202   -0.3147 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