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
   -1.7174   -0.1513    1.0601 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8703   -0.0829   -0.2152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7636   -0.0410   -1.4452 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0163   -1.2841   -0.3028 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1087   -1.2406    0.5397 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7254    0.0046    0.5751 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7856    0.9405    1.0364 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0408    1.1798   -0.0885 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1123    0.0811    0.8797 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6377    0.4650   -0.4229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6135    0.5072    0.9711 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1043    0.2905    1.8982 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9448   -1.1768    1.3522 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8020   -0.2187   -1.1462 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7157    0.9636   -1.9342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4719   -0.8428   -2.1806 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5631   -2.2103   -0.0209 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3447   -1.3862   -1.3574 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6937    2.0561    0.0672 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5691    1.3109   -0.9956 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0179   -0.0008    1.4639 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9835    0.8364   -1.3766 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