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
    2.9694   -0.2113    0.9124 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7222    0.1665    0.1935 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8424    0.8896   -0.9024 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4330   -0.2496    0.6879 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3554   -0.9395    1.7378 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7334    0.0937    0.0310 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9556   -0.3347    0.5517 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1384    0.1042   -0.2537 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7348   -0.5843    0.6244 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.2079   -1.2478    0.6172 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8110    0.4279    0.6012 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8703   -0.0921    2.0138 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7915    1.2165   -1.2980 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9423    1.1664   -1.4277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9573   -1.4559    0.5897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1056    0.0515    1.5915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1101   -0.2328   -1.3008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2103    1.2315   -0.2124 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