Monomers

6,6-Dimethyl-4,8-dioxaspiro[2.5]oct-1-ene

Identifiers

IUPAC name
6,6-dimethyl-4,8-dioxaspiro[2.5]oct-1-ene
InchI
InChI=1S/C8H12O2/c1-7(2)5-9-8(3-4-8)10-6-7/h3-4H,5-6H2,1-2H3
InchI Key
AINMINDCBBSFAO-UHFFFAOYSA-N
SMILES
CC1(C)COC2(OC1)C=C2
Canonical SMILES
CC1(COC2(C=C2)OC1)C
Isomeric SMILES
CC1(COC2(C=C2)OC1)C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H12O2
Heavy Atom Count
10
Molecular Weight
140.182
Exact Molecular Weight
140.0837
Valence Electrons
56
Radical Electrons
0
tPSA
18.46
MolLogP
1.3255
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
0
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
2
Aromatic Rings
0

MOL File


     RDKit          3D

 22 23  0  0  0  0  0  0  0  0999 V2000
   -1.6117    0.4000   -1.5568 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8436   -0.0140   -0.3032 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8971   -0.3949    0.7286 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0087   -1.1921   -0.6602 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1976   -1.2913   -0.0512 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7348   -0.1510    0.4592 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8071    0.5806    1.2278 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0512    1.1473    0.2558 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7835    0.6182   -0.1619 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1226   -0.2479    0.9439 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2929    1.2334   -1.3446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1642   -0.5278   -1.8752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8655    0.5992   -2.3351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9120   -0.3851    0.3277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6964   -1.4349    1.0938 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8728    0.2763    1.6055 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1257   -1.2697   -1.7798 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6060   -2.1134   -0.3896 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6975    1.8718    0.7400 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5635    1.5430   -0.5712 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2128    1.3117   -0.8599 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9721   -0.5594    1.5363 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  6  9  1  0
  9 10  2  0
  8  2  1  0
 10  6  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  3 14  1  0
  3 15  1  0
  3 16  1  0
  4 17  1  0
  4 18  1  0
  8 19  1  0
  8 20  1  0
  9 21  1  0
 10 22  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers