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
   -1.2342    0.4984   -0.4154 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6274   -0.6305    0.3319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3391   -1.5356    0.8284 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8020   -0.7011    0.4980 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5575    0.2370   -0.0148 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2949    0.2612   -0.5746 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1458    1.4521    0.1774 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7061    0.6606   -1.4002 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2421   -1.5180    1.0386 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1073    1.0491   -0.5534 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6388    0.2268    0.0842 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