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
   -1.3763   -0.2061    0.1121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3145    0.7773    0.3977 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5855    1.8769    0.9247 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0787    0.5311    0.0898 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3614   -0.6312   -0.4667 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4103   -1.0210    0.8600 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2756   -0.6874   -0.8799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3548    0.3519    0.0749 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8550    1.2341    0.2915 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6325   -1.3850   -0.6977 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3895   -0.8404   -0.7062 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