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
   -3.8810   -0.5942   -1.3247 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.1272    0.2344    0.0226 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6468    0.1195    0.0296 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8094    1.0118   -0.5949 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5583    0.8264   -0.5365 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1233   -0.2313    0.1318 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2956   -1.1408    0.7671 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0624   -0.9307    0.6920 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5497   -0.4870    0.2335 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3978    0.3323   -0.3437 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5202   -0.2320    0.9683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3622    1.3267    0.0166 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2512    1.8556   -1.1284 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1913    1.5380   -1.0329 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7087   -1.9841    1.3016 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7044   -1.6437    1.1898 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9345   -1.3428    0.7777 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4713    0.1356   -0.2643 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1345    1.2062   -0.9053 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