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
   -2.8396   -0.6462    0.7805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7036    0.0877    0.1939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9221    1.2284   -0.4075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3682   -0.4603    0.2903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1804   -1.5772    0.8830 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7503    0.1882   -0.2460 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9954   -0.4296   -0.0966 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1219    0.3614   -0.7135 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3019    2.1070    0.0566 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.6507   -0.6595    0.0217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5687   -1.7061    0.9798 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2517   -0.1581    1.6821 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8950    1.6831   -0.5085 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0837    1.7569   -0.8331 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2574   -0.6792    0.9507 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9595   -1.4036   -0.6571 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0768   -0.1752   -0.5666 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0004    0.4823   -1.8098 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