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
   -0.7405    2.0546   -0.9989 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.4893    0.3600   -0.1245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5235   -0.3845    0.2118 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8490   -0.0977    0.1648 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9879   -1.2065    0.7358 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0041    0.5910   -0.1380 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3348   -1.3254    0.6993 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5484   -0.0898    0.0187 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7955    0.0982   -0.5691 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