(Trans,trans)-4-methoxy-4′-propyl-1,1′-bicyclohexyl

C₁₆H₃₀OCAS 97398-80-6238.41 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₆H₃₀O
Molar mass: 238.41 g/mol
Exact mass: 238.2297 Da
Melting point: 10 °C
logP: 4.80Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 4

Identifiers

CAS number

97398-80-6

SMILES

CCC[C@H]1CC[C@H]([C@H]2CC[C@H](OC)CC2)CC1

InChIKey

JMOYCPSDEMHCFG-BIAGXBKMNA-N

InChI

InChI=1/C16H30O/c1-3-4-13-5-7-14(8-6-13)15-9-11-16(17-2)12-10-15/h13-16H,3-12H2,1-2H3/t13-,14-,15-,16-

Weigh it out

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

Names and synonyms

7 names

CC-3-O1
1,1′-Bicyclohexyl, 4-methoxy-4′-propyl-, (trans,trans)-
Trans,trans-4-Methoxy-4′-propylcyclohexylcyclohexane
3O1CCH
CCH 3O1
3-HH-O1
CCH-301

Work with (Trans,trans)-4-methoxy-4′-propyl-1,1′-bicyclohexyl

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

Same formula

(Z)-11-Hexadecenal53939-28-9 (±)-Muscone541-91-3 7-Hexadecyn-1-ol822-21-9

Elsewhere

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