Monomers

2-Bromoethyl methacrylate

Identifiers

IUPAC name
2-bromoethyl 2-methylprop-2-enoate
InchI
InChI=1S/C6H9BrO2/c1-5(2)6(8)9-4-3-7/h1,3-4H2,2H3
InchI Key
AOUSBQVEVZBMNI-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)OCCBr
Canonical SMILES
CC(=C)C(=O)OCCBr
Isomeric SMILES
CC(=C)C(=O)OCCBr
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H9BrO2
Heavy Atom Count
9
Molecular Weight
193.04
Exact Molecular Weight
191.9786
Valence Electrons
52
Radical Electrons
0
tPSA
26.3
MolLogP
1.5006
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 18 17  0  0  0  0  0  0  0  0999 V2000
    1.5348   -2.4391   -0.4700 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2948   -1.6519   -0.2952 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8486   -2.2323   -0.1017 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3143   -0.1682   -0.3349 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3912    0.4413   -0.5186 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8146    0.5706   -0.1762 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0433    1.9093   -0.1620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4884    2.7582    0.9153 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4100    2.7470    0.9799 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.2415   -2.0983    0.3412 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0104   -2.1627   -1.4478 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3345   -3.5162   -0.4000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7412   -1.6599    0.0239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9108   -3.3023   -0.0655 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1779    2.0464   -0.1055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8207    2.4225   -1.1454 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7991    3.8399    0.7748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8870    2.4958    1.9281 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  2  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  3 13  1  0
  3 14  1  0
  7 15  1  0
  7 16  1  0
  8 17  1  0
  8 18  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers