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
   -2.0390   -1.1473    0.0361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9068   -0.1661    0.2213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4912    1.1639    0.6371 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0991   -0.6871    1.2094 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0957    0.2953    1.3686 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6849    0.5321    0.1578 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8202    1.0174   -0.8141 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1495    0.0428   -1.0901 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0704    1.0703    0.2037 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8301   -0.2146   -0.3240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4987   -1.3161    1.0217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7087   -2.0734   -0.4716 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8169   -0.6976   -0.6108 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7252    1.9014    0.9246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2074    1.0667    1.4669 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0600    1.5420   -0.2561 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6185   -1.5502    0.7059 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3365   -0.9987    2.1679 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3876   -0.8807   -1.3625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8348    0.3909   -1.8658 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8587    1.7895    0.4099 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3093   -1.0804   -0.7669 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