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
   -2.9469    0.6166    0.2585 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6401   -0.1089    0.4463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6106   -1.2716    1.0762 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4130    0.4726   -0.0667 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4815    1.5761   -0.6581 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8247   -0.1788    0.0917 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9453    0.4945   -0.4544 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1857   -0.3151   -0.2101 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9712   -2.0246   -1.0577 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.7268    0.1293    0.8833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2649    0.6003   -0.8050 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8509    1.6762    0.6282 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6636   -1.7695    1.1971 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4819   -1.7583    1.4808 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0629    1.4964    0.0425 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7331    0.6100   -1.5419 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2673   -0.4674    0.8905 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0900    0.2222   -0.5216 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