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
   -1.3241   -0.4971   -0.1377 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5471    0.7942   -0.0990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1440    1.8817   -0.2127 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8918    0.7356    0.0717 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5415   -0.4020    0.1936 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1018   -0.9585   -1.0960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9716   -1.1336    0.6749 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4074   -0.2692    0.0158 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4548    1.6483    0.1006 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0046   -1.3511    0.1691 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6032   -0.4483    0.3196 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