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
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
3.4183 0.7284 0.9996 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4146 0.6631 0.1598 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8276 -0.5648 -0.0799 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4355 -0.7873 -0.0497 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0889 -0.4443 1.3293 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5474 -0.8149 1.3695 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2795 -0.0153 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3805 0.7975 -0.5505 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3103 -0.0955 -1.1425 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9115 1.6566 1.2229 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7670 -0.1614 1.4843 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0842 1.5796 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3034 -1.9040 -0.1522 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0697 0.6077 1.5884 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4461 -1.1268 2.0393 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9673 -0.6762 2.4041 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6701 -1.8891 1.1454 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8871 -0.6861 -0.3313 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0476 0.6759 0.7908 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9476 1.6833 -0.0448 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0135 1.1507 -1.4127 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3282 0.4753 -1.8386 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8664 -0.8522 -1.7701 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