Monomers

Methyl vinyl ketone

Identifiers

IUPAC name
but-3-en-2-one
InchI
InChI=1S/C4H6O/c1-3-4(2)5/h3H,1H2,2H3
InchI Key
FUSUHKVFWTUUBE-UHFFFAOYSA-N
SMILES
CC(=O)C=C
Canonical SMILES
CC(=O)C=C
Isomeric SMILES
CC(=O)C=C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H6O
Heavy Atom Count
5
Molecular Weight
70.091
Exact Molecular Weight
70.0419
Valence Electrons
28
Radical Electrons
0
tPSA
17.07
MolLogP
0.7614
H Bond Acceptors
1
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

 11 10  0  0  0  0  0  0  0  0999 V2000
   -1.2659    0.3350    0.5890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2868    0.7344   -0.4385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5944    1.7657   -1.1180 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9507    0.0378   -0.6962 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3059   -1.0300   -0.0181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1830   -0.7102    0.9130 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2862    0.4902    0.1780 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1987    0.9886    1.5058 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6173    0.3893   -1.4648 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7057   -1.4656    0.7771 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2354   -1.5351   -0.2274 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  2  3
  1  6  1  0
  1  7  1  0
  1  8  1  0
  4  9  1  0
  5 10  1  0
  5 11  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers