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
    3.7694   -0.8262   -1.4516 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.0993    0.2775   -0.2126 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6370    0.1039   -0.1693 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8238    0.8721   -0.9739 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5396    0.7178   -0.9407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1003   -0.2090   -0.0999 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2770   -0.9883    0.7161 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0855   -0.8337    0.6827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5322   -0.4137   -0.0242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3977    0.2649   -0.7472 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5857   -0.0212    0.7478 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2968    1.3441   -0.4678 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2150    1.6176   -1.6553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1891    1.3073   -1.5603 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6774   -1.7316    1.3947 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7673   -1.4114    1.2936 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9297   -1.1673    0.6641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1625    1.0318   -1.4620 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4742    0.0652   -0.6465 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