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
   -2.1693    1.0981   -0.6640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7016   -0.1825   -0.0812 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5461   -1.0783    0.3960 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2678   -0.4086   -0.0587 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1622   -1.4743    0.4238 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6447    0.4917   -0.5421 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0053    0.1950   -0.4787 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5774   -0.0086    0.8793 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4850   -0.4033    0.7096 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.4610    1.4445   -1.4281 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2082    1.0456   -1.0369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1451    1.8436    0.1818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6106   -0.9058    0.3770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2019   -2.0102    0.8199 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5572    1.0442   -0.9767 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2824   -0.6935   -1.1119 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1548   -0.8804    1.4131 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4426    0.8828    1.5265 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