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
    1.9600   -0.3617    0.0362 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8236    0.1175    0.6827 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2331    0.3207   -0.1807 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3795    0.7979    0.4350 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8575   -0.0718    1.4116 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2519   -0.3050   -1.4734 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0710    1.0475   -1.4650 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7952   -0.5174    0.7483 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2966    0.3658   -0.7277 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7730   -1.3626   -0.4265 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1165   -1.0616    1.0215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0738   -0.1137    2.2112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7645    0.3438    1.8945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3825   -1.1352   -2.1459 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3400    1.9358   -2.0218 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