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
   -1.6754    0.0692    0.5689 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2839    0.4898    0.3275 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0306    1.6675    0.5274 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7024   -0.4660   -0.1382 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9596   -0.1357   -0.3681 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6579   -0.6145    1.4524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1487   -0.4179   -0.3079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3395    0.9077    0.8522 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4318   -1.5101   -0.3174 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6742   -0.8676   -0.7148 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3067    0.8776   -0.2149 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