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
   -1.7025   -0.1301   -0.6029 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3995    0.4185   -0.1596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4088    1.5454    0.3990 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8176   -0.3264   -0.3701 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0123    0.1207    0.0085 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3609    0.7058   -0.8976 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5707   -0.8455   -1.4607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1793   -0.7524    0.2086 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7418   -1.2889   -0.8582 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1750    1.0513    0.4922 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8750   -0.4984   -0.1860 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