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
   -3.7847    0.5363    1.5540 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1157   -0.0747    0.0396 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6204   -0.1267    0.1420 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9185    0.9972   -0.2463 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4640    0.9139   -0.1383 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1178   -0.2067    0.3237 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3730   -1.3056    0.7002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0002   -1.2515    0.6038 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5711   -0.2591    0.4238 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3803    0.7261    0.0940 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4488   -1.0946   -0.2133 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3965    0.6703   -0.7591 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4139    1.9005   -0.6170 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0218    1.7835   -0.4380 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8803   -2.1891    1.0640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5895   -2.1281    0.9044 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0063   -1.1868    0.8004 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4628    0.6413    0.1860 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0109    1.6538   -0.2789 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