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
   -1.2862   -0.5224    0.1409 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5021    0.7213    0.3309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0996    1.7334    0.7790 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9074    0.7506    0.0051 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4936   -0.3277   -0.4593 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3563   -0.2766    0.2475 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0826   -0.9859   -0.8555 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9783   -1.2387    0.9494 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4363    1.6876    0.1621 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9195   -1.2282   -0.5945 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5483   -0.3135   -0.7056 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