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
   -1.6402    0.5890   -1.3252 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9949   -0.0967   -0.1659 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9502   -0.8332    0.7155 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2348    0.9588    0.6433 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8879    1.2863   -0.1519 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7905    0.2218   -0.0082 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1255   -0.9646    0.2752 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0798   -1.0640   -0.6711 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8981    0.0827   -0.9706 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1480    0.4664    0.4416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3849    1.6849   -1.3618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7525    0.5555   -1.2140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4003    0.0982   -2.2919 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3468   -1.4223    1.4450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4698   -1.5929    0.0778 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6648   -0.1517    1.1772 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1470    0.5087    1.5935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8548    1.8404    0.8553 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5060   -0.6949   -1.6276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2972   -2.0906   -0.7540 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4634   -0.0907   -1.8639 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9452    0.7088    1.0935 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