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
   -2.2323   -1.0278    0.4818 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7040    0.1954   -0.1294 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4986    1.0171   -0.7459 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2826    0.4915   -0.0457 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1213    1.5612   -0.5906 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6341   -0.2856    0.5670 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9875   -0.1357    0.7119 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8695   -0.1599   -0.4741 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6064    1.1681   -1.8001 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.4257   -1.6840    0.8790 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8676   -0.7721    1.3635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8844   -1.6108   -0.1975 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5692    0.7560   -0.7871 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1584    1.9433   -1.2194 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3318   -0.9866    1.3909 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2539    0.7650    1.3701 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8863   -1.2014   -0.9229 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9318   -0.0339   -0.0960 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