Monomers

2,4-Dibromostyrene

Identifiers

IUPAC name
2,4-dibromo-1-ethenylbenzene
InchI
InChI=1S/C8H6Br2/c1-2-6-3-4-7(9)5-8(6)10/h2-5H,1H2
InchI Key
NTHFKMZKTASAMH-UHFFFAOYSA-N
SMILES
C=Cc1ccc(cc1Br)Br
Canonical SMILES
C=CC1=C(C=C(C=C1)Br)Br
Isomeric SMILES
C=CC1=C(C=C(C=C1)Br)Br
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H6Br2
Heavy Atom Count
10
Molecular Weight
261.944
Exact Molecular Weight
259.8836
Valence Electrons
52
Radical Electrons
0
tPSA
0.0
MolLogP
3.8546
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
   -2.7615    0.2779   -0.4685 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8810   -0.5617    0.0043 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4736   -0.2704    0.0431 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4652   -1.2960   -0.2006 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8113   -1.0620   -0.1466 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3326    0.1769    0.1462 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4467    1.1899    0.3878 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0651    0.9521    0.3336 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0818    2.4381    0.7480 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.2310    0.4704    0.2128 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -2.5151    1.2329   -0.8612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8284   -0.0448   -0.4503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2077   -1.5468    0.3981 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0478   -2.2660   -0.4298 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5203   -1.8672   -0.3380 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8289    2.1767    0.6211 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
  8  9  1  0
  6 10  1  0
  8  3  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  4 14  1  0
  5 15  1  0
  7 16  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers