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
   -2.0109    1.2435   -0.2649 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7730   -0.2085   -0.1080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8111   -1.0172   -0.0745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4299   -0.7450    0.0077 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2647   -1.9844    0.1398 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7091    0.0367   -0.0185 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0167   -0.5148    0.0971 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0777    0.5407    0.0398 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0288    1.5191   -1.6154 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -1.1602    1.7792    0.2120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1560    1.5455   -1.3214 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9290    1.5773    0.2832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8252   -0.6611   -0.1569 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7048   -2.0987    0.0391 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0754   -0.9888    1.1088 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2109   -1.2967   -0.6447 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0522    0.0449    0.2114 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8939    1.2285    0.9098 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