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
   -0.5166   -1.0979    1.2214 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5716   -0.0284    0.2207 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6285    0.5816    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6236    0.3216   -0.5233 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6617    1.2642   -1.4349 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4299   -1.0789    1.8653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4379   -2.1023    0.7324 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3998   -0.9483    1.8638 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5584   -0.2140   -0.3337 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5634    1.4831   -1.9532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2224    1.8193   -1.6605 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