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
   -1.7235    0.1834   -0.0319 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2872    0.3041    0.3289 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0083    0.9930    1.3459 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7375   -0.3525   -0.4709 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9909   -0.2431   -0.1504 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3691    0.4353    0.8036 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8850   -0.8684   -0.3635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9403    0.8788   -0.8778 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4664   -0.9348   -1.3353 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2810    0.3291    0.7021 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7376   -0.7247   -0.7376 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