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
    2.9318   -0.7199   -0.3042 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7043    0.0979   -0.4073 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7625    1.3699   -0.7893 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4174   -0.5068   -0.0838 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3732   -1.7088    0.2759 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7755    0.2117   -0.1614 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9684   -0.4409    0.1656 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1798    0.4153    0.0495 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1401    1.9585    1.1840 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.7258   -1.6726   -0.8508 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1007   -0.9684    0.7615 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8236   -0.2150   -0.6710 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8885    1.9920   -0.8743 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7343    1.7800   -1.0198 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8883   -0.8369    1.1918 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0936   -1.3125   -0.5026 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3570    0.7609   -0.9892 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0596   -0.2043    0.3598 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