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
   -2.6216   -0.9797    0.4416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6441    0.0939    0.1621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0238    1.3319    0.3918 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3070   -0.2400   -0.3521 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0123   -1.4471   -0.5484 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6489    0.6732   -0.6354 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9409    0.5559   -1.1084 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9515   -0.1399   -0.2860 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6600   -1.9554    0.1432 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.2603   -0.6697    1.3164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1318   -1.9516    0.6708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3265   -1.1105   -0.4086 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9928    1.6041    0.7666 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2788    2.1072    0.1756 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2993    1.6276   -1.2640 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9681    0.1706   -2.1839 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2038    0.4156    0.6514 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9263   -0.0861   -0.8677 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