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
   -1.7195   -0.2168    0.1094 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2830   -0.4802    0.2470 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0977   -1.5777    0.7148 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6922    0.5183   -0.1538 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9869    0.2714   -0.0257 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3214   -1.1352    0.1162 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9188    0.3563   -0.8183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0143    0.4518    0.9573 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3893    1.4761   -0.5615 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7332    0.9985   -0.3169 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3577   -0.6625    0.3732 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