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
   -1.6984   -0.2028   -0.2535 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4033    0.3918    0.0836 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3484    1.6115    0.3769 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8546   -0.3591    0.1007 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0040    0.1881    0.4045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7598   -1.2926    0.0029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4966    0.2814    0.3524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9839   -0.0151   -1.3177 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8428   -1.4084   -0.1462 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8841   -0.4217    0.3968 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1051    1.2267    0.6626 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