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
   -2.6501   -0.7774   -0.5839 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6452    0.2516   -0.2229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0105    1.5167   -0.2836 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3210   -0.1797    0.1759 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0040   -1.3994    0.2259 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6863    0.7214    0.5322 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9870    0.3334    0.9249 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7298   -0.4376   -0.1218 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4852   -0.8685    0.6219 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.5446   -0.7347    0.0648 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2475   -1.8040   -0.5218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9297   -0.6254   -1.6565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2649    2.2559   -0.0167 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9778    1.8239   -0.5753 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9886   -0.2117    1.8907 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5456    1.2783    1.1131 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9381    0.2006   -1.0088 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2266   -1.3434   -0.4764 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