chempirical

1-Ethoxy-4-(trans-4-propylcyclohexyl)benzene

C17H26OCAS 80944-44-1246.39 g/mol

Open in Covalent MOL file
O
Ether

Properties

Molecular formula
C17H26O
Molar mass
246.39 g/mol
Exact mass
246.1984 Da
logP
5.16Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
5
Stereocentres
r, sin SMILES atom order

Identifiers

CAS number
80944-44-1
SMILES
CCC[C@H]1CC[C@H](c2ccc(OCC)cc2)CC1
InChIKey
OXBRRUNAAVNTOZ-SHTZXODSNA-N
InChI
InChI=1/C17H26O/c1-3-5-14-6-8-15(9-7-14)16-10-12-17(13-11-16)18-4-2/h10-15H,3-9H2,1-2H3/t14-,15-

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

17 names · show all
  • Benzene, 1-ethoxy-4-(trans-4-propylcyclohexyl)-
  • Benzene, 1-ethoxy-4-(4-propylcyclohexyl)-, trans-
  • 4-(trans-4-Propylcyclohexyl)-1-ethoxybenzene
  • trans-1-Ethoxy-4-(4-propylcyclohexyl)benzene
  • 4-(trans-4-Propylcyclohexyl)ethoxybenzene
  • 4-(trans-4-n-Propylcyclohexyl)ethoxybenzene
  • trans-1-(p-Ethoxyphenyl)-4-propylcyclohexane
  • PEC
  • trans-4-Propyl-1-(4-ethoxyphenyl)cyclohexane
  • PCH 3O2
  • 4-Ethoxy-1-(trans-4-propylcyclohexyl)benzene
  • trans-4-(4-Ethoxyphenyl)-1-propylcyclohexane
  • 3-HB-O2
  • CP-3-O2
  • (Trans)-4-Ethoxy-1-(4-propylcyclohexyl)benzene
  • (Trans)-1-(4-Ethoxyphenyl)-4-propylcyclohexane
  • 3CPO2

Work with 1-Ethoxy-4-(trans-4-propylcyclohexyl)benzene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Ethoxy-4-(trans-4-pentylcyclohexyl)benzene84540-32-980 % similar 1-Methoxy-4-(trans-4-propylcyclohexyl)benzene81936-32-569 % similar 4-(trans-4-Propylcyclohexyl)phenol81936-33-658 % similar 1-Bromo-4-(trans-4-propylcyclohexyl)benzene86579-53-558 % similar 1-[(Trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-yl]-4-(trifluoromethoxy)benzene133937-72-157 % similar 4-Ethoxy-2,3-difluoro-4′-(trans-4-propylcyclohexyl)-1,1′-biphenyl189750-98-957 % similar 1-Methyl-4-[(trans,trans)-4′-propyl[1,1′-bicyclohexyl]-4-yl]benzene84656-75-755 % similar 4-(trans-4-Propylcyclohexyl)benzonitrile61203-99-454 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1-[2,4,6-Tris(1-methylethyl)phenyl]ethanone2234-14-2 Acetylcedrene32388-55-9 1-(4-Nonylphenyl)ethanone37593-05-8 4-(trans-4-Pentylcyclohexyl)phenol82575-69-7

Elsewhere

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