Monomers

(Vinyloxy)cyclohexane

Identifiers

IUPAC name
ethenoxycyclohexane
InchI
InChI=1S/C8H14O/c1-2-9-8-6-4-3-5-7-8/h2,8H,1,3-7H2
InchI Key
VGIYPVFBQRUBDD-UHFFFAOYSA-N
SMILES
C=COC1CCCCC1
Canonical SMILES
C=COC1CCCCC1
Isomeric SMILES
C=COC1CCCCC1
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H14O
Heavy Atom Count
9
Molecular Weight
126.199
Exact Molecular Weight
126.1045
Valence Electrons
52
Radical Electrons
0
tPSA
9.23
MolLogP
2.4792
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
1
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0

MOL File


     RDKit          3D

 23 23  0  0  0  0  0  0  0  0999 V2000
    3.0014    0.7512   -0.2692 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7644   -0.4716    0.1948 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6213   -0.7429    0.9325 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4053   -0.2085    0.4399 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0850   -0.7216   -0.9513 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3866   -0.3856   -1.1962 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7624    0.8344   -0.3856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8250    0.5010    1.0886 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7675   -0.5832    1.3229 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3455    1.5803   -0.1084 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9057    0.9230   -0.8414 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4529   -1.2748    0.0081 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5112    0.8963    0.4662 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2801   -1.7928   -0.9665 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6827   -0.1484   -1.6987 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5134   -0.1858   -2.2630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0441   -1.2198   -0.8743 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7583    1.1972   -0.7387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0547    1.6642   -0.5979 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4405    1.3968    1.6439 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8182    0.1866    1.4045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4964   -0.6177    2.3980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1883   -1.5783    0.9918 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9  4  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  4 13  1  0
  5 14  1  0
  5 15  1  0
  6 16  1  0
  6 17  1  0
  7 18  1  0
  7 19  1  0
  8 20  1  0
  8 21  1  0
  9 22  1  0
  9 23  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers