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
    1.8292    1.0977   -0.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8413   -0.0387   -0.1277 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6142   -1.3446   -0.0454 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0474    0.0754    1.1588 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9090    1.0699    0.9678 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7506    0.6263   -0.0525 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0956    0.8628   -1.2554 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0201   -0.0293   -1.3511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1641    0.7708    0.1191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5642   -0.5672    0.1241 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7276    0.7979    0.3855 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4043    2.0475    0.1800 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1728    1.2003   -1.2671 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2268   -1.4980   -0.9359 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9087   -2.1974    0.0862 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2188   -1.2760    0.8974 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7313    0.3735    1.9555 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4981   -0.8705    1.3525 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4024   -1.0597   -1.5634 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6185    0.2992   -2.2059 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1142    1.2506    0.2111 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8226   -1.5904    0.2195 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