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
   -2.8291   -0.2029    0.1977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8335    0.6536    0.2518 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4560    0.2310    0.0734 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0401   -1.0532   -0.1626 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3115   -1.3825   -0.3242 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2862   -0.4153   -0.2510 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8835    0.8799   -0.0143 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5510    1.1984    0.1440 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0415    3.0002    0.4690 Br  0  0  0  0  0  0  0  0  0  0  0  0
    4.1153   -0.8776   -0.4722 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -2.6197   -1.2358    0.0181 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8622    0.0870    0.3272 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0820    1.7060    0.4377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7543   -1.8337   -0.2275 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6199   -2.3996   -0.5093 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6680    1.6444    0.0424 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