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
   -1.7658   -1.1390    0.1682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8863    0.1141    0.0394 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8358    1.2526   -0.2732 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1569    0.3157    1.3235 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1750    0.2224    1.3066 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8422   -0.3008    0.2863 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1634   -0.7313   -0.8131 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0507   -0.0125   -1.1358 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1009   -1.0537    0.5765 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2646    0.1753    0.1162 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2674   -1.3724   -0.7927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1691   -1.9593    0.5653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5921   -0.8314    0.8740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5039    1.8416   -1.1663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9092    1.9836    0.5621 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8583    0.9173   -0.4910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5636   -0.3720    2.1234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4394    1.3443    1.7010 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3287    1.0388   -1.4280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4888   -0.4864   -1.9553 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6111   -1.9563    0.9184 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9001    1.0094   -0.1931 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