4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol

C16H30O2 — CID 102283442

IUPAC4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol
SMILESCC(C)(C)C1CCC(OC2CCC(O)CC2)CC1
InChIInChI=1S/C16H30O2/c1-16(2,3)12-4-8-14(9-5-12)18-15-10-6-13(17)7-11-15/h12-15,17H,4-11H2,1-3H3
InChIKeyFQKHFCIKEDBVOA-UHFFFAOYSA-N
MW254.41 g/mol
LogP3.91
Rot. Bonds2

About 4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol

4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol (PubChem CID 102283442) has the molecular formula C16H30O2 and a molecular weight of 254.41 g/mol. Its IUPAC name is 4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol.

Molecular Properties

Compound Name4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol
PubChem CID102283442
Molecular FormulaC16H30O2
Molecular Weight254.41 g/mol
Exact Mass254.22
IUPAC Name4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol
SMILESCC(C)(C)C1CCC(OC2CCC(O)CC2)CC1
InChIInChI=1S/C16H30O2/c1-16(2,3)12-4-8-14(9-5-12)18-15-10-6-13(17)7-11-15/h12-15,17H,4-11H2,1-3H3
InChIKeyFQKHFCIKEDBVOA-UHFFFAOYSA-N
XLogP3.91
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.41
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-tert-butylcyclohexan-1-ol;methane
CID 159612628
4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol
CID 70671036
4-[2-[4-[1-[4-[1-[4-[2-(4-hydroxycyclohexyl)propan-2-yl]cyclohexyl]oxyethoxy]cyclohexyl]oxyethoxy]cyclohexyl]propan-2-yl]cyclohexan-1-ol
CID 140509318
4-[2-[4-[4,4-bis(trifluoromethyl)oxetan-2-yl]oxycyclohexyl]propan-2-yl]cyclohexan-1-ol
CID 89385994
methane;4-(2-methoxypropan-2-yl)cyclohexan-1-ol;2-[4-(2-methoxypropan-2-yl)cyclohexyl]oxyoxane
CID 162219430
bis(4-tert-butylcyclohexyl) ethanediperoxoate
CID 102003397
1-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)-4-[4-(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl)cyclohexyl]oxycyclohexane
CID 122695112
dipotassium;[4-[4-[1,1-bis(4-hydroxycyclohexyl)ethyl]cyclohexyl]oxycyclohexyl]-(4-phosphonatocyclohexyl)methanone
CID 140510351
cyclopropyloxycyclopropane
CID 19900876
(4-tert-butylcyclohexyl) hydroxy carbonate;hydron
CID 174417276
(2R,3R)-2,3-bis[(4-tert-butylcyclohexyl)oxy]butanedioic acid
CID 70926789
CID 172766760
CID 172766760

Frequently Asked Questions

What is the IUPAC name of 4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol?
The IUPAC name of 4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol (CID 102283442) is 4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol.
What is the SMILES notation for 4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol?
The canonical SMILES for 4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol is CC(C)(C)C1CCC(OC2CCC(O)CC2)CC1.
What is the InChIKey of 4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol?
The InChIKey is FQKHFCIKEDBVOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O2/c1-16(2,3)12-4-8-14(9-5-12)18-15-10-6-13(17)7-11-15/h12-15,17H,4-11H2,1-3H3.
What are the key properties of 4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol?
4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol has a molecular weight of 254.41 g/mol, XLogP of 3.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol is sourced from PubChem (CID 102283442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).