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
   -2.3372   -1.0973    1.2235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5780   -0.5184    0.0715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2836   -0.1088   -0.9567 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1444   -0.4474    0.1600 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4933   -0.8474    1.1552 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5544    0.0863   -0.9023 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9435    0.2154   -0.9478 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5175    1.0832    0.1401 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4457    1.1958   -0.0160 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.7250   -1.0303    2.1358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5023   -2.1731    0.9924 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3294   -0.6216    1.3447 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7264    0.3126   -1.7945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3429   -0.1602   -1.0243 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4663   -0.7750   -0.8687 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1895    0.6974   -1.9371 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1418    2.1311    0.0842 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2172    0.7121    1.1398 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