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
3.8380 -0.2454 -0.3613 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6329 0.2497 -0.4937 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5061 -0.5744 -0.6472 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4185 -0.3143 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0367 1.0712 -0.0183 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4555 1.0699 -0.5929 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2810 0.4784 0.5461 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9910 -0.9993 0.5772 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6226 -1.3735 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9696 -1.3065 -0.3701 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6776 0.3981 -0.2463 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5339 1.3348 -0.4805 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8831 -0.3308 1.2534 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5552 1.6453 -0.7597 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1108 1.6314 0.9322 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8149 2.0749 -0.8185 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5051 0.4046 -1.4933 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3555 0.6494 0.4172 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9493 0.9669 1.4856 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7485 -1.4899 -0.0709 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2073 -1.3486 1.6103 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6423 -1.7433 -0.9104 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2945 -2.2484 0.7428 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