Monomers

3,3-Dimethoxycyclopropene

Identifiers

IUPAC name
3,3-dimethoxycyclopropene
InchI
InChI=1S/C5H8O2/c1-6-5(7-2)3-4-5/h3-4H,1-2H3
InchI Key
LOWCCDYETQYXQP-UHFFFAOYSA-N
SMILES
COC1(OC)C=C1
Canonical SMILES
COC1(C=C1)OC
Isomeric SMILES
COC1(C=C1)OC
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H8O2
Heavy Atom Count
7
Molecular Weight
100.117
Exact Molecular Weight
100.0524
Valence Electrons
40
Radical Electrons
0
tPSA
18.46
MolLogP
0.5453
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0

MOL File


     RDKit          3D

 15 15  0  0  0  0  0  0  0  0999 V2000
   -1.8065   -0.6129   -0.5908 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4328   -0.7855   -0.6618 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2626    0.3670   -0.3027 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6588    0.1857   -0.3768 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9996   -0.8384    0.4923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1726    1.1865    0.8263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2648    1.6851   -0.5539 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2644   -1.5834   -0.8947 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1790    0.1370   -1.3282 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1681   -0.4155    0.4346 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0999   -1.0102    0.4601 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6928   -0.5378    1.5271 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5284   -1.7951    0.2202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3704    1.4615    1.8249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5835    2.5561   -1.0765 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  3  6  1  0
  6  7  2  0
  7  3  1  0
  1  8  1  0
  1  9  1  0
  1 10  1  0
  5 11  1  0
  5 12  1  0
  5 13  1  0
  6 14  1  0
  7 15  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers