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
   -2.1141   -1.3043   -0.2767 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6747    0.0076    0.2068 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4477    0.8419    0.8757 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2913    0.4459   -0.0564 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1321    1.5666    0.3401 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6056   -0.3469   -0.7479 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9060    0.0778   -0.9880 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7295    0.3572    0.2238 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9310   -1.1887    1.3614 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.3715   -1.7346   -0.9551 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2788   -1.9519    0.6284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1002   -1.2260   -0.7842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4688    0.5399    1.0804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1072    1.8042    1.2241 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9588    0.9915   -1.6349 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4228   -0.7543   -1.5512 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7768    0.6226   -0.1102 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3915    1.2517    0.7822 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