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
    2.7009    0.6739   -0.1086 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5949   -0.2556    0.2007 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8464   -1.5405    0.2567 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2415    0.2235    0.4428 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0329    1.4610    0.3819 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8196   -0.6052    0.7343 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1400   -0.1603    0.9724 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7239    0.5816   -0.2067 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7448   -0.6155   -1.7356 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.6967    0.2558    0.1686 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5885    1.5925    0.5257 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7630    0.9171   -1.1898 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8485   -1.8759    0.0758 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0352   -2.2395    0.4850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7544   -1.0947    1.1050 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2344    0.3931    1.9163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7818    0.7999    0.0382 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1495    1.4886   -0.4531 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