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
   -1.9711    0.9481    0.5121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8817    0.1212   -0.1696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6188   -0.7950   -1.1473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1807   -0.7760    0.8136 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0343   -1.1333    0.3087 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8789   -0.1282   -0.0228 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3131    1.0773   -0.3345 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0709    1.0200   -0.9042 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2531   -0.1485    0.3885 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0113   -0.5454   -0.9288 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6751    0.2936    1.0345 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5273    1.7246    1.1635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5176    1.4544   -0.3222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9432   -1.4651   -1.6777 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3927   -1.3147   -0.5403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1495   -0.1514   -1.8848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7865   -1.7188    0.9287 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1441   -0.3332    1.8393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3461    2.0692   -0.8876 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1213    0.6956   -1.9721 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0534   -0.0069    1.1051 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3980   -0.8876   -1.8591 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