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
   -1.1982   -0.5137   -0.5130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5113   -0.2275    0.7632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0230   -0.4610    1.8776 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8375    0.3591    0.7643 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4069    0.6181   -0.3988 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5903    0.4195   -0.9895 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5082   -1.0621   -1.1999 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0736   -1.1664   -0.2688 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3553    0.5751    1.6904 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3966    1.0483   -0.3803 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9084    0.4106   -1.3454 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