Monomers

2-Bromoacrylic acid

Identifiers

IUPAC name
2-bromoprop-2-enoic acid
InchI
InChI=1S/C3H3BrO2/c1-2(4)3(5)6/h1H2,(H,5,6)
InchI Key
HMENQNSSJFLQOP-UHFFFAOYSA-N
SMILES
BrC(=C)C(=O)O
Canonical SMILES
C=C(C(=O)O)Br
Isomeric SMILES
C=C(C(=O)O)Br
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C3H3BrO2
Heavy Atom Count
6
Molecular Weight
150.959
Exact Molecular Weight
149.9316
Valence Electrons
34
Radical Electrons
0
tPSA
37.3
MolLogP
0.9796
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

  9  8  0  0  0  0  0  0  0  0999 V2000
   -1.1495    2.1133   -0.0416 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.5121    0.3353    0.1974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1830   -0.4997    0.9598 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7225   -0.1233   -0.4581 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1272   -1.3010   -0.2882 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4717    0.7081   -1.2716 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0931   -0.1731    1.4474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7895   -1.5066    1.0734 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4058    0.4468   -1.6185 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
  3  7  1  0
  3  8  1  0
  6  9  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers