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
    2.2406   -0.9880   -0.0844 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7997    0.3646   -0.4286 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6888    1.3058   -0.6962 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3793    0.7126   -0.4864 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0082    1.8786   -0.7833 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6233   -0.2085   -0.2214 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9942    0.1929   -0.2944 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9277   -0.9257    0.0208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7329   -0.2405   -0.1165 Br  0  0  0  0  0  0  0  0  0  0  0  0
    1.3808   -1.6812   -0.2021 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5354   -1.0113    0.9994 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0636   -1.3663   -0.7106 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3832    2.3228   -0.9556 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7506    1.1355   -0.6765 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2552    0.5842   -1.2980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1516    1.0079    0.4570 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7442   -1.3797    1.0187 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8008   -1.7039   -0.7879 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