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
   -1.4340    1.3619    0.3148 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9520    0.0050   -0.0765 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1458   -0.8952   -0.2984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0874    0.1158   -1.3169 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0578   -0.6646   -1.1720 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8552   -0.2027   -0.1448 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1529   -0.0821    1.0566 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0978   -0.6532    0.9919 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9494    0.7493   -0.4106 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2381   -0.6642   -0.1496 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5404    1.3751    0.5253 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3159    2.0721   -0.5493 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9466    1.7674    1.2250 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4216   -1.3142    0.7112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9186   -1.7488   -0.9506 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0079   -0.2924   -0.6167 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6431   -0.1521   -2.2136 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2556    1.1700   -1.4149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5593   -0.5842    1.9914 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0480   -1.7164    0.6587 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4235    1.6748   -0.6278 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0899   -1.3214   -0.0785 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