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
   -1.3243   -1.2248   -0.6419 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9610    0.0161    0.1585 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2106    0.6002    0.7757 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2039    1.0177   -0.6737 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1092    1.1478   -0.3761 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8120    0.0434   -0.0391 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1007   -0.9876    0.5256 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0159   -0.4665    1.2416 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1101    0.3276    0.6597 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1504   -0.1957   -0.6120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7105   -1.3296   -1.5452 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1542   -2.1593   -0.0316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4140   -1.2160   -0.8458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2030    1.7031    0.6244 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1178    0.2301    0.2597 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1946    0.4224    1.8521 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7025    2.0128   -0.4912 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3591    0.8126   -1.7541 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3030    0.3510    1.9088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5005   -1.2469    1.8286 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6947    0.6791    1.5177 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7598   -0.5376   -1.4394 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