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
   -2.1350    0.6985   -1.0248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7310    0.0904    0.2527 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5918   -0.0665    1.2358 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3380   -0.3442    0.4178 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0696   -0.8694    1.4812 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5823   -0.2033   -0.5646 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8959   -0.5015   -0.6792 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9251    0.1146    0.1737 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7695   -0.1895    2.0587 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -2.3429   -0.0467   -1.8248 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3648    1.3861   -1.4446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0561    1.3208   -0.8809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3193   -0.5095    2.1810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6142    0.2468    1.1287 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2119   -0.3236   -1.7515 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0096   -1.6179   -0.5791 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1235    1.1893   -0.0526 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9056   -0.3744   -0.1275 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