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
    2.0871    0.2188    0.9387 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6934   -0.5767   -0.2361 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5397   -1.3303   -0.8795 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3068   -0.5280   -0.7074 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0853   -1.1856   -1.7042 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6304    0.2566   -0.0591 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9569    0.2736   -0.5482 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8470    1.1781    0.2725 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9128    0.5937    2.1105 Br  0  0  0  0  0  0  0  0  0  0  0  0
    3.1127    0.6260    0.7230 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3745    1.0501    1.1189 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1118   -0.3967    1.8718 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5754   -1.3738   -0.5366 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2595   -1.9177   -1.7430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0360    0.4606   -1.6213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3487   -0.7740   -0.3897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8340    1.2259   -0.1928 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4096    2.1994    0.2412 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