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
   -1.9060    0.4978    1.4293 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6380    0.1061    0.0144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6201    0.1775   -0.8451 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3000   -0.3343   -0.3351 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0663   -0.6647   -1.5193 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6821   -0.3869    0.6078 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0042   -0.7915    0.3949 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6792    0.0902   -0.6151 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6356    1.9015    0.1085 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.9689    0.5727    2.0179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4699   -0.3583    1.8764 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4282    1.4541    1.5000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5302   -0.0835   -1.8941 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5913    0.5122   -0.5250 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0967   -1.8794    0.1402 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5463   -0.6339    1.3716 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7356   -0.2547   -0.7157 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1390    0.0750   -1.5731 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