Monomers

4-Bromostyrene

Identifiers

IUPAC name
1-bromo-4-ethenylbenzene
InchI
InChI=1S/C8H7Br/c1-2-7-3-5-8(9)6-4-7/h2-6H,1H2
InchI Key
WGGLDBIZIQMEGH-UHFFFAOYSA-N
SMILES
C=Cc1ccc(cc1)Br
Canonical SMILES
C=CC1=CC=C(C=C1)Br
Isomeric SMILES
C=CC1=CC=C(C=C1)Br
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H7Br
Heavy Atom Count
9
Molecular Weight
183.048
Exact Molecular Weight
181.9731
Valence Electrons
46
Radical Electrons
0
tPSA
0.0
MolLogP
3.0921
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

 16 16  0  0  0  0  0  0  0  0999 V2000
   -0.8259    2.5063   -0.9727 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4126    1.3433   -1.3740 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0836    0.2884   -0.4376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1740    0.4102    0.9183 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1584   -0.6467    1.7828 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5845   -1.8315    1.2518 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6775   -1.9596   -0.1181 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3552   -0.9326   -0.9756 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0463   -3.2917    2.3722 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9424    2.7396    0.0596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0646    3.2750   -1.6868 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3243    1.1969   -2.4546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5084    1.3393    1.3425 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0661   -0.4895    2.8540 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0200   -2.9160   -0.5033 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4279   -1.0313   -2.0586 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  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
  8  3  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  4 13  1  0
  5 14  1  0
  7 15  1  0
  8 16  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers